N-(2-phenylpropyl)pyridine-3-carboxamide

C15H16N2O — CID 46446505

IUPACN-(2-phenylpropyl)pyridine-3-carboxamide
SMILESCC(CNC(=O)c1cccnc1)c1ccccc1
InChIInChI=1S/C15H16N2O/c1-12(13-6-3-2-4-7-13)10-17-15(18)14-8-5-9-16-11-14/h2-9,11-12H,10H2,1H3,(H,17,18)
InChIKeyQQOJINQQUIGIJJ-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.62
Rot. Bonds4

About N-(2-phenylpropyl)pyridine-3-carboxamide

N-(2-phenylpropyl)pyridine-3-carboxamide (PubChem CID 46446505) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is N-(2-phenylpropyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-phenylpropyl)pyridine-3-carboxamide
PubChem CID46446505
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC NameN-(2-phenylpropyl)pyridine-3-carboxamide
SMILESCC(CNC(=O)c1cccnc1)c1ccccc1
InChIInChI=1S/C15H16N2O/c1-12(13-6-3-2-4-7-13)10-17-15(18)14-8-5-9-16-11-14/h2-9,11-12H,10H2,1H3,(H,17,18)
InChIKeyQQOJINQQUIGIJJ-UHFFFAOYSA-N
XLogP2.62
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-3-(pyridine-3-carbonylamino)propanoic acid
CID 53211442
N-[(2S)-2-hydroxypropyl]pyridine-3-carboxamide
CID 39237258
N-[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-2-phenylethyl]pyridine-3-carboxamide
CID 146220042
N-[(2R)-2-hydroxy-3-[(1S)-1-phenylethoxy]propyl]pyridine-3-carboxamide
CID 96538610
N-(2-phenyl-2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 110362884
N-[(2R)-2-phenylpropyl]-1-pyridin-3-ylpyrrole-2-carboxamide
CID 93055498
N-[2-(4-phenylphenyl)propyl]pyridine-4-carboxamide
CID 59093479
4-methyl-N-[(2R)-2-phenylpropyl]benzamide
CID 9302175
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]pyridine-3-carboxamide;dihydrochloride
CID 119526338
N-[(4-butan-2-ylphenyl)methyl]pyridine-3-carboxamide
CID 110780451
phenyl (2S,3R)-3-hydroxy-2-[(pyridine-3-carbonylamino)methyl]butanoate
CID 164711213
N-[2-oxo-2-[[(1S)-1-pyridin-3-ylethyl]amino]ethyl]pyridine-3-carboxamide
CID 166223531

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylpropyl)pyridine-3-carboxamide?
The IUPAC name of N-(2-phenylpropyl)pyridine-3-carboxamide (CID 46446505) is N-(2-phenylpropyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-phenylpropyl)pyridine-3-carboxamide?
The canonical SMILES for N-(2-phenylpropyl)pyridine-3-carboxamide is CC(CNC(=O)c1cccnc1)c1ccccc1.
What is the InChIKey of N-(2-phenylpropyl)pyridine-3-carboxamide?
The InChIKey is QQOJINQQUIGIJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-12(13-6-3-2-4-7-13)10-17-15(18)14-8-5-9-16-11-14/h2-9,11-12H,10H2,1H3,(H,17,18).
What are the key properties of N-(2-phenylpropyl)pyridine-3-carboxamide?
N-(2-phenylpropyl)pyridine-3-carboxamide has a molecular weight of 240.31 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylpropyl)pyridine-3-carboxamide is sourced from PubChem (CID 46446505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).