5-Aminopyrazole-3-carboxamide - CAS 1219743-26-6

Catalog:	BB005311
Product Name:	5-Aminopyrazole-3-carboxamide
CAS:	1219743-26-6
Synonyms:	3-amino-1H-pyrazole-5-carboxamide; 3-amino-1H-pyrazole-5-carboxamide

Technical Data

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Computed Properties

IUPAC Name:	3-amino-1H-pyrazole-5-carboxamide
Description:	5-Aminopyrazole-3-carboxamide (CAS# 1219743-26-6) is a useful research chemical.
Molecular Weight:	126.12
Molecular Formula:	C4H6N4O
Canonical SMILES:	C1=C(NN=C1N)C(=O)N
InChI:	InChI=1S/C4H6N4O/c5-3-1-2(4(6)9)7-8-3/h1H,(H2,6,9)(H3,5,7,8)
InChI Key:	RMTDSXQVNSXONV-UHFFFAOYSA-N
Storage:	Keep in dark place, Sealed in dry, 2-8 °C
MDL:	MFCD14702869
LogP:	-0.09490

Publication Number	Title	Priority Date
CN-111423377-A	5-amino-1H-pyrazole derivative, preparation method and medical application	20200512
CN-111423377-B	5-amino-1H-pyrazole derivative, preparation method and medical application	20200512
CN-111212644-A	Amorphous solid dispersions of 5-aminopyrazole carboxamide compounds as BTK inhibitors	20171110
CN-111225669-A	Crystalline form I of 5-aminopyrazole carboxamide compounds as BTK inhibitors	20171110
CN-111225912-A	5-aminopyrazole carboxamide compounds as BTK inhibitors and preparation method thereof	20171110

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	126
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	126.05416083
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	126.05416083
Rotatable Bond Count:	1
Topological Polar Surface Area:	97.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.9