2-(aminomethyl)pyridine-4-carboxamide;hydrochloride

C7H10ClN3O — CID 135395084

IUPAC2-(aminomethyl)pyridine-4-carboxamide;hydrochloride
SMILESCl.NCc1cc(C(N)=O)ccn1
InChIInChI=1S/C7H9N3O.ClH/c8-4-6-3-5(7(9)11)1-2-10-6;/h1-3H,4,8H2,(H2,9,11);1H
InChIKeyGUCIVAWVDYYQLL-UHFFFAOYSA-N
MW187.63 g/mol
LogP0.06
Rot. Bonds2

About 2-(aminomethyl)pyridine-4-carboxamide;hydrochloride

2-(aminomethyl)pyridine-4-carboxamide;hydrochloride (PubChem CID 135395084) has the molecular formula C7H10ClN3O and a molecular weight of 187.63 g/mol. Its IUPAC name is 2-(aminomethyl)pyridine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-(aminomethyl)pyridine-4-carboxamide;hydrochloride
PubChem CID135395084
Molecular FormulaC7H10ClN3O
Molecular Weight187.63 g/mol
Exact Mass187.05
IUPAC Name2-(aminomethyl)pyridine-4-carboxamide;hydrochloride
SMILESCl.NCc1cc(C(N)=O)ccn1
InChIInChI=1S/C7H9N3O.ClH/c8-4-6-3-5(7(9)11)1-2-10-6;/h1-3H,4,8H2,(H2,9,11);1H
InChIKeyGUCIVAWVDYYQLL-UHFFFAOYSA-N
XLogP0.06
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.63
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(chloromethyl)pyridine-4-carboxamide
CID 22993396
2-(aminomethyl)-N-(4-carbamoylphenyl)pyridine-4-carboxamide
CID 114325508
1-[2-(aminomethyl)-4-pyridinyl]-2-methylprop-2-en-1-one
CID 116601826
2-(1,3-oxazol-4-ylmethyl)pyridine-4-carboxamide
CID 67080027
[2-(aminomethyl)-4-pyridinyl]-pyrimidin-5-ylmethanone
CID 116601786
1-[2-(aminomethyl)-4-pyridinyl]-2-methoxyethanone
CID 116601798
N-(2-aminoethyl)-2-(aminomethyl)pyridine-4-carboxamide
CID 114326296
2-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]pyridine-4-carboxamide
CID 114326678
2-(aminomethyl)-N-(thiatriazol-5-yl)pyridine-4-carboxamide
CID 114912577
[2-(aminomethyl)-4-pyridinyl]-(azocan-1-yl)methanone
CID 114325572
tert-butyl 2-(aminomethyl)pyridine-4-carboxylate
CID 114325005
[2-(aminomethyl)-4-pyridinyl]-(azepan-1-yl)methanone
CID 112530475

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)pyridine-4-carboxamide;hydrochloride?
The IUPAC name of 2-(aminomethyl)pyridine-4-carboxamide;hydrochloride (CID 135395084) is 2-(aminomethyl)pyridine-4-carboxamide;hydrochloride.
What is the SMILES notation for 2-(aminomethyl)pyridine-4-carboxamide;hydrochloride?
The canonical SMILES for 2-(aminomethyl)pyridine-4-carboxamide;hydrochloride is Cl.NCc1cc(C(N)=O)ccn1.
What is the InChIKey of 2-(aminomethyl)pyridine-4-carboxamide;hydrochloride?
The InChIKey is GUCIVAWVDYYQLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O.ClH/c8-4-6-3-5(7(9)11)1-2-10-6;/h1-3H,4,8H2,(H2,9,11);1H.
What are the key properties of 2-(aminomethyl)pyridine-4-carboxamide;hydrochloride?
2-(aminomethyl)pyridine-4-carboxamide;hydrochloride has a molecular weight of 187.63 g/mol, XLogP of 0.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)pyridine-4-carboxamide;hydrochloride is sourced from PubChem (CID 135395084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).