4-Amino-1-(2-pyrimidinyl)piperidine - CAS 412355-81-8

Catalog:	BB024827
Product Name:	4-Amino-1-(2-pyrimidinyl)piperidine
CAS:	412355-81-8
Synonyms:	1-(2-pyrimidinyl)-4-piperidinamine; 1-pyrimidin-2-ylpiperidin-4-amine

Technical Data

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Computed Properties

IUPAC Name:	1-pyrimidin-2-ylpiperidin-4-amine
Description:	4-Amino-1-(2-pyrimidinyl)piperidine (CAS# 412355-81-8) is a useful research chemical.
Molecular Weight:	178.23
Molecular Formula:	C9H14N4
Canonical SMILES:	C1CN(CCC1N)C2=NC=CC=N2
InChI:	InChI=1S/C9H14N4/c10-8-2-6-13(7-3-8)9-11-4-1-5-12-9/h1,4-5,8H,2-3,6-7,10H2
InChI Key:	USLXJAKPMUUGPV-UHFFFAOYSA-N
Boiling Point:	340.6 °C at 760 mmHg
Density:	1.144 g/cm³
MDL:	MFCD06616818
LogP:	1.16940

Publication Number	Title	Priority Date
US-2021198239-A1	Compounds and methods for cd73 modulation and indications therefor	20191206
WO-2021113625-A1	Compounds and methods for cd73 modulation and indications therefor	20191206
US-2020071326-A1	Tam kinase inhibitors	20170414
EP-3538091-A1	PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF	20161108
US-10414727-B2	Phenyl amino piperidine mTORC inhibitors and uses thereof	20161108

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P317, P330, and P501
Signal Word:	Warning

Complexity:	148
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	178.121846464
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	178.121846464
Rotatable Bond Count:	1
Topological Polar Surface Area:	55
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3