N-(1-phenylpropyl)pyridine-2-carboxamide

C15H16N2O — CID 5305559

IUPACN-(1-phenylpropyl)pyridine-2-carboxamide
SMILESCCC(NC(=O)c1ccccn1)c1ccccc1
InChIInChI=1S/C15H16N2O/c1-2-13(12-8-4-3-5-9-12)17-15(18)14-10-6-7-11-16-14/h3-11,13H,2H2,1H3,(H,17,18)
InChIKeyPAXGZHDLMSJCFZ-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.96
Rot. Bonds4

About N-(1-phenylpropyl)pyridine-2-carboxamide

N-(1-phenylpropyl)pyridine-2-carboxamide (PubChem CID 5305559) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is N-(1-phenylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-phenylpropyl)pyridine-2-carboxamide
PubChem CID5305559
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC NameN-(1-phenylpropyl)pyridine-2-carboxamide
SMILESCCC(NC(=O)c1ccccn1)c1ccccc1
InChIInChI=1S/C15H16N2O/c1-2-13(12-8-4-3-5-9-12)17-15(18)14-10-6-7-11-16-14/h3-11,13H,2H2,1H3,(H,17,18)
InChIKeyPAXGZHDLMSJCFZ-UHFFFAOYSA-N
XLogP2.96
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 ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(1-phenylpropylcarbamoyl)pyridine-2-carboxylic acid
CID 62304057
1-N,4-N-bis(1-phenylpropyl)benzene-1,4-dicarboxamide
CID 43912072
N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
CID 43392707
N-(1-phenylpropyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19416921
(2R,3S)-3-methyl-2-(pyridine-2-carbonylamino)pentanoic acid
CID 30054092
(2R,3R)-3-methyl-2-(pyridine-2-carbonylamino)pentanoic acid
CID 30054086
N-(1-bromobutan-2-yl)pyridine-2-carboxamide
CID 114307782
6-chloro-N-(1-phenylpropyl)pyridine-3-carboxamide
CID 17168005
N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide
CID 94572874
N-[phenyl(pyridin-4-yl)methyl]pyridine-2-carboxamide
CID 47007723
6-(ethylamino)-N-(1-phenylpropyl)pyridazine-3-carboxamide
CID 62303897
N-[(1R)-1-phenylpropyl]-1,6-naphthyridine-2-carboxamide
CID 16731063

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpropyl)pyridine-2-carboxamide?
The IUPAC name of N-(1-phenylpropyl)pyridine-2-carboxamide (CID 5305559) is N-(1-phenylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(1-phenylpropyl)pyridine-2-carboxamide?
The canonical SMILES for N-(1-phenylpropyl)pyridine-2-carboxamide is CCC(NC(=O)c1ccccn1)c1ccccc1.
What is the InChIKey of N-(1-phenylpropyl)pyridine-2-carboxamide?
The InChIKey is PAXGZHDLMSJCFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-2-13(12-8-4-3-5-9-12)17-15(18)14-10-6-7-11-16-14/h3-11,13H,2H2,1H3,(H,17,18).
What are the key properties of N-(1-phenylpropyl)pyridine-2-carboxamide?
N-(1-phenylpropyl)pyridine-2-carboxamide has a molecular weight of 240.31 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 5305559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).