6-phenyl-N-prop-2-enylpyridine-3-carboxamide

C15H14N2O — CID 110683620

IUPAC6-phenyl-N-prop-2-enylpyridine-3-carboxamide
SMILESC=CCNC(=O)c1ccc(-c2ccccc2)nc1
InChIInChI=1S/C15H14N2O/c1-2-10-16-15(18)13-8-9-14(17-11-13)12-6-4-3-5-7-12/h2-9,11H,1,10H2,(H,16,18)
InChIKeyKTKNFMJCOZERCR-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.66
Rot. Bonds4

About 6-phenyl-N-prop-2-enylpyridine-3-carboxamide

6-phenyl-N-prop-2-enylpyridine-3-carboxamide (PubChem CID 110683620) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 6-phenyl-N-prop-2-enylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-phenyl-N-prop-2-enylpyridine-3-carboxamide
PubChem CID110683620
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name6-phenyl-N-prop-2-enylpyridine-3-carboxamide
SMILESC=CCNC(=O)c1ccc(-c2ccccc2)nc1
InChIInChI=1S/C15H14N2O/c1-2-10-16-15(18)13-8-9-14(17-11-13)12-6-4-3-5-7-12/h2-9,11H,1,10H2,(H,16,18)
InChIKeyKTKNFMJCOZERCR-UHFFFAOYSA-N
XLogP2.66
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-[(6-phenylpyridine-3-carbonyl)amino]ethylcarbamic acid
CID 135122283
2-N,5-N-bis(prop-2-enyl)pyridine-2,5-dicarboxamide
CID 4069560
N-prop-2-enyl-4-[4-(prop-2-enylcarbamoyl)phenyl]benzamide
CID 3714314
N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide
CID 110683628
5-phenyl-N-prop-2-enyl-1,2,4-triazine-3-carboxamide
CID 13330636
6-(3-phenyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-prop-2-enylpyridine-3-carboxamide
CID 133327677
6-methyl-N-[2-(prop-2-enylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 18158456
6-[[(3-fluorophenyl)-phenylmethyl]amino]-N-prop-2-enylpyridine-3-carboxamide
CID 133350466
phenyl-(6-phenyl-3-pyridinyl)methanone
CID 10890606
6-(2-phenoxyanilino)-N-prop-2-enylpyridine-3-carboxamide
CID 109151538
N-phenyl-6-pyridin-4-ylpyridine-3-carboxamide
CID 174640985
N-(4-tert-butylphenyl)-6-phenylpyridine-3-carboxamide
CID 11450343

Frequently Asked Questions

What is the IUPAC name of 6-phenyl-N-prop-2-enylpyridine-3-carboxamide?
The IUPAC name of 6-phenyl-N-prop-2-enylpyridine-3-carboxamide (CID 110683620) is 6-phenyl-N-prop-2-enylpyridine-3-carboxamide.
What is the SMILES notation for 6-phenyl-N-prop-2-enylpyridine-3-carboxamide?
The canonical SMILES for 6-phenyl-N-prop-2-enylpyridine-3-carboxamide is C=CCNC(=O)c1ccc(-c2ccccc2)nc1.
What is the InChIKey of 6-phenyl-N-prop-2-enylpyridine-3-carboxamide?
The InChIKey is KTKNFMJCOZERCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-2-10-16-15(18)13-8-9-14(17-11-13)12-6-4-3-5-7-12/h2-9,11H,1,10H2,(H,16,18).
What are the key properties of 6-phenyl-N-prop-2-enylpyridine-3-carboxamide?
6-phenyl-N-prop-2-enylpyridine-3-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyl-N-prop-2-enylpyridine-3-carboxamide is sourced from PubChem (CID 110683620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).