3-Amino-5-chloropyridine-2-carbonitrile - CAS 408538-29-4

Catalog:	BB024696
Product Name:	3-Amino-5-chloropyridine-2-carbonitrile
CAS:	408538-29-4
Synonyms:	3-amino-5-chloro-2-pyridinecarbonitrile; 3-amino-5-chloropyridine-2-carbonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	3-amino-5-chloropyridine-2-carbonitrile
Description:	3-Amino-5-chloropyridine-2-carbonitrile (CAS# 408538-29-4) is a useful research chemical.
Molecular Weight:	153.57
Molecular Formula:	C6H4ClN3
Canonical SMILES:	C1=C(C(=NC=C1Cl)C#N)N
InChI:	InChI=1S/C6H4ClN3/c7-4-1-5(9)6(2-8)10-3-4/h1,3H,9H2
InChI Key:	MIPHUHMTGIOLGI-UHFFFAOYSA-N
LogP:	1.77008

Publication Number	Title	Priority Date
WO-2019170543-A1	Identification and use of erk5 inhibitors	20180307
AU-2019232437-A1	Identification and use of ERK5 inhibitors	20180307
EP-3762379-A1	Identification and use of erk5 inhibitors	20180307
US-2021017174-A1	Identification and use of erk5 inhibitor	20180307
US-2011237576-A1	2-aminopyrimidin-4-one and 2-aminopyridine derivatives both having bace1-inhibiting activity	20081022

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Related Functional Groups

Nitrogen Compounds

[1427004-19-0]
DBCO-PEG4-NHS ester
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[1243387-55-4]
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[78056-67-4]
2-(1-Benzyl-4-piperidyl)acetonitrile

Complexity:	162
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	153.0093748
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	153.0093748
Rotatable Bond Count:	0
Topological Polar Surface Area:	62.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4