3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide

C12H19N3O — CID 104742079

IUPAC3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide
SMILESCCC(NC(=O)c1ncccc1N)C(C)C
InChIInChI=1S/C12H19N3O/c1-4-10(8(2)3)15-12(16)11-9(13)6-5-7-14-11/h5-8,10H,4,13H2,1-3H3,(H,15,16)
InChIKeyGANHVHJXJUKAKW-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.83
Rot. Bonds4

About 3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide

3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide (PubChem CID 104742079) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide
PubChem CID104742079
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide
SMILESCCC(NC(=O)c1ncccc1N)C(C)C
InChIInChI=1S/C12H19N3O/c1-4-10(8(2)3)15-12(16)11-9(13)6-5-7-14-11/h5-8,10H,4,13H2,1-3H3,(H,15,16)
InChIKeyGANHVHJXJUKAKW-UHFFFAOYSA-N
XLogP1.83
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylpentan-3-ylcarbamoyl)pyridine-3-carboxylic acid
CID 55247596
(2S)-2-[(3-aminopyridine-2-carbonyl)amino]-3-methylpentanoic acid
CID 104741920
3-[(3-aminopyridine-2-carbonyl)amino]pentanoic acid
CID 104742756
(2S)-2-[(3-aminopyridine-2-carbonyl)amino]-3-methylbutanoic acid
CID 104741916
(2R)-2-[(3-aminopyridine-2-carbonyl)amino]propanoic acid
CID 104742099
3-amino-N-(2-methyl-1-phenylpropyl)pyridine-2-carboxamide
CID 104741223
3-amino-N-[1-(4-ethylphenyl)ethyl]pyridine-2-carboxamide
CID 104741215
2-hydrazinyl-N-(2-methylpentan-3-yl)pyridine-3-carboxamide
CID 62248528
3-[(3-aminopyridine-2-carbonyl)amino]-4,4-dimethylpentanoic acid
CID 104742758
methyl 2-[(3-aminopyridine-2-carbonyl)amino]-4-methylpentanoate
CID 104741240
3-amino-N-[1-(4-fluorophenyl)-2-methylpropyl]pyridine-2-carboxamide
CID 104741224
(2S)-2-[(3-aminopyridine-2-carbonyl)amino]-3-hydroxypropanoic acid
CID 104741912

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide (CID 104742079) is 3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide is CCC(NC(=O)c1ncccc1N)C(C)C.
What is the InChIKey of 3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide?
The InChIKey is GANHVHJXJUKAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-4-10(8(2)3)15-12(16)11-9(13)6-5-7-14-11/h5-8,10H,4,13H2,1-3H3,(H,15,16).
What are the key properties of 3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide?
3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methylpentan-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 104742079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).