6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide

C16H19N3O — CID 62072779

IUPAC6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
SMILESCC(CCc1ccccc1)NC(=O)c1ccc(N)nc1
InChIInChI=1S/C16H19N3O/c1-12(7-8-13-5-3-2-4-6-13)19-16(20)14-9-10-15(17)18-11-14/h2-6,9-12H,7-8H2,1H3,(H2,17,18)(H,19,20)
InChIKeyFSNGDXITICWOLG-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.41
Rot. Bonds5

About 6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide

6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide (PubChem CID 62072779) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
PubChem CID62072779
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
SMILESCC(CCc1ccccc1)NC(=O)c1ccc(N)nc1
InChIInChI=1S/C16H19N3O/c1-12(7-8-13-5-3-2-4-6-13)19-16(20)14-9-10-15(17)18-11-14/h2-6,9-12H,7-8H2,1H3,(H2,17,18)(H,19,20)
InChIKeyFSNGDXITICWOLG-UHFFFAOYSA-N
XLogP2.41
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-butan-2-ylpyridine-3-carboxamide
CID 62072773
6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide
CID 62073113
3-amino-N-[(2R)-4-phenylbutan-2-yl]pyrazine-2-carboxamide
CID 30138259
N-(4-phenylbutan-2-yl)-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 24603270
5,6-dichloro-N-[(2S)-4-phenylbutan-2-yl]pyridine-3-carboxamide
CID 7987043
N-(4-phenylbutan-2-yl)-4-sulfanylbenzamide
CID 107026940
N-(4-phenylbutan-2-yl)pyridine-4-carboxamide
CID 3246771
N-[(2S)-4-phenylbutan-2-yl]-4-propan-2-yloxybenzamide
CID 1263174
6-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-3-carboxamide
CID 63009864
[4-(4-phenylbutan-2-ylcarbamoyl)phenyl] acetate
CID 3865423
4-(carbamoylamino)-N-[(2S)-4-phenylbutan-2-yl]benzamide
CID 26013431
6-amino-N-[5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide
CID 62153221

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide (CID 62072779) is 6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide is CC(CCc1ccccc1)NC(=O)c1ccc(N)nc1.
What is the InChIKey of 6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide?
The InChIKey is FSNGDXITICWOLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-12(7-8-13-5-3-2-4-6-13)19-16(20)14-9-10-15(17)18-11-14/h2-6,9-12H,7-8H2,1H3,(H2,17,18)(H,19,20).
What are the key properties of 6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide?
6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 62072779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).