(3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride

C10H16ClN3 — CID 71636735

IUPAC(3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride
SMILESCl.c1cncc(CN[C@@H]2CCNC2)c1
InChIInChI=1S/C10H15N3.ClH/c1-2-9(6-11-4-1)7-13-10-3-5-12-8-10;/h1-2,4,6,10,12-13H,3,5,7-8H2;1H/t10-;/m1./s1
InChIKeyWHHQKXPHDMPWAW-HNCPQSOCSA-N
MW213.71 g/mol
LogP0.95
Rot. Bonds3

About (3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride

(3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride (PubChem CID 71636735) has the molecular formula C10H16ClN3 and a molecular weight of 213.71 g/mol. Its IUPAC name is (3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride.

Molecular Properties

Compound Name(3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride
PubChem CID71636735
Molecular FormulaC10H16ClN3
Molecular Weight213.71 g/mol
Exact Mass213.10
IUPAC Name(3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride
SMILESCl.c1cncc(CN[C@@H]2CCNC2)c1
InChIInChI=1S/C10H15N3.ClH/c1-2-9(6-11-4-1)7-13-10-3-5-12-8-10;/h1-2,4,6,10,12-13H,3,5,7-8H2;1H/t10-;/m1./s1
InChIKeyWHHQKXPHDMPWAW-HNCPQSOCSA-N
XLogP0.95
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-N-(pyridin-3-ylmethyl)piperidin-3-amine
CID 53256527
1-N,4-N-bis(pyridin-3-ylmethyl)cyclohexane-1,4-diamine
CID 139088209
1-N,3-N,5-N-tris(pyridin-3-ylmethyl)cyclohexane-1,3,5-triamine
CID 177421480
(3S)-N-(pyrazin-2-ylmethyl)pyrrolidin-3-amine;hydrochloride
CID 71636752
N-(pyridin-3-ylmethyl)pyrrolidin-2-amine
CID 90939130
N-(pyridin-3-ylmethyl)thian-4-amine
CID 43394819
4,4-difluoro-N-(pyridin-3-ylmethyl)cyclohexan-1-amine
CID 126787190
(3R)-N-(pyrazin-2-ylmethyl)pyrrolidin-3-amine
CID 71304599
(3R)-N-(pyridin-4-ylmethyl)piperidin-3-amine;trihydrochloride
CID 53256507
8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 43131751
N-piperidin-3-yl-2-pyridin-3-ylacetamide
CID 63321155
N-(pyrimidin-2-ylmethyl)pyrrolidin-3-amine
CID 89348963

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride?
The IUPAC name of (3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride (CID 71636735) is (3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride.
What is the SMILES notation for (3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride?
The canonical SMILES for (3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride is Cl.c1cncc(CN[C@@H]2CCNC2)c1.
What is the InChIKey of (3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride?
The InChIKey is WHHQKXPHDMPWAW-HNCPQSOCSA-N. The full InChI is InChI=1S/C10H15N3.ClH/c1-2-9(6-11-4-1)7-13-10-3-5-12-8-10;/h1-2,4,6,10,12-13H,3,5,7-8H2;1H/t10-;/m1./s1.
What are the key properties of (3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride?
(3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride has a molecular weight of 213.71 g/mol, XLogP of 0.95, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride is sourced from PubChem (CID 71636735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).