N-(2-amino-4-methylpentyl)pyridine-2-carboxamide

C12H19N3O — CID 107158631

IUPACN-(2-amino-4-methylpentyl)pyridine-2-carboxamide
SMILESCC(C)CC(N)CNC(=O)c1ccccn1
InChIInChI=1S/C12H19N3O/c1-9(2)7-10(13)8-15-12(16)11-5-3-4-6-14-11/h3-6,9-10H,7-8,13H2,1-2H3,(H,15,16)
InChIKeyMUQADOYLUSLCPK-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.18
Rot. Bonds5

About N-(2-amino-4-methylpentyl)pyridine-2-carboxamide

N-(2-amino-4-methylpentyl)pyridine-2-carboxamide (PubChem CID 107158631) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(2-amino-4-methylpentyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-methylpentyl)pyridine-2-carboxamide
PubChem CID107158631
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-(2-amino-4-methylpentyl)pyridine-2-carboxamide
SMILESCC(C)CC(N)CNC(=O)c1ccccn1
InChIInChI=1S/C12H19N3O/c1-9(2)7-10(13)8-15-12(16)11-5-3-4-6-14-11/h3-6,9-10H,7-8,13H2,1-2H3,(H,15,16)
InChIKeyMUQADOYLUSLCPK-UHFFFAOYSA-N
XLogP1.18
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-phenylpropyl]pyridine-2-carboxamide
CID 9302014
methyl 2-iodo-3-(pyridine-2-carbonylamino)propanoate
CID 103493160
N-(2-cyanopropyl)pyridine-2-carboxamide
CID 62651477
N-(2-amino-4-methylpentyl)quinoline-4-carboxamide
CID 107158826
N-(2-amino-4-methylpentyl)-2-fluorobenzamide
CID 107158830
N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide
CID 107158805
4-[(2-amino-4-methylpentyl)amino]-N-ethylpyridine-2-carboxamide
CID 107159414
N-(2-bromo-2-phenylethyl)pyridine-2-carboxamide
CID 114308424
N-[(2S)-2-(ethylamino)-3-oxopentyl]pyridine-2-carboxamide
CID 162019589
3-methoxy-4-(pyridine-2-carbonylamino)butanoic acid
CID 103152963
N-[2-(diethylamino)-2-phenylethyl]pyridine-2-carboxamide
CID 42917068
acetic acid;N-ethylpyridine-2-carboxamide
CID 174901243

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methylpentyl)pyridine-2-carboxamide?
The IUPAC name of N-(2-amino-4-methylpentyl)pyridine-2-carboxamide (CID 107158631) is N-(2-amino-4-methylpentyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-amino-4-methylpentyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2-amino-4-methylpentyl)pyridine-2-carboxamide is CC(C)CC(N)CNC(=O)c1ccccn1.
What is the InChIKey of N-(2-amino-4-methylpentyl)pyridine-2-carboxamide?
The InChIKey is MUQADOYLUSLCPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9(2)7-10(13)8-15-12(16)11-5-3-4-6-14-11/h3-6,9-10H,7-8,13H2,1-2H3,(H,15,16).
What are the key properties of N-(2-amino-4-methylpentyl)pyridine-2-carboxamide?
N-(2-amino-4-methylpentyl)pyridine-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 1.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-methylpentyl)pyridine-2-carboxamide is sourced from PubChem (CID 107158631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).