5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide

C15H15ClN2O2 — CID 125490443

IUPAC5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide
SMILESCCCc1[nH]c(=O)c(C(=O)Nc2ccccc2)cc1Cl
InChIInChI=1S/C15H15ClN2O2/c1-2-6-13-12(16)9-11(15(20)18-13)14(19)17-10-7-4-3-5-8-10/h3-5,7-9H,2,6H2,1H3,(H,17,19)(H,18,20)
InChIKeyDJHXIHIPOPELAP-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.23
Rot. Bonds4

About 5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide

5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide (PubChem CID 125490443) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide
PubChem CID125490443
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide
SMILESCCCc1[nH]c(=O)c(C(=O)Nc2ccccc2)cc1Cl
InChIInChI=1S/C15H15ClN2O2/c1-2-6-13-12(16)9-11(15(20)18-13)14(19)17-10-7-4-3-5-8-10/h3-5,7-9H,2,6H2,1H3,(H,17,19)(H,18,20)
InChIKeyDJHXIHIPOPELAP-UHFFFAOYSA-N
XLogP3.23
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-oxo-6-phenyl-N-(4-propylphenyl)-1H-pyridine-3-carboxamide
CID 112830494
5-iodo-6-methyl-2-oxo-N-phenyl-1H-pyridine-3-carboxamide
CID 125490765
5-chloro-6-ethyl-2-oxo-N-[(2R)-pentan-2-yl]-1H-pyridine-3-carboxamide
CID 125490940
6-methyl-4-oxo-N-phenyl-1H-pyridine-3-carboxamide
CID 110856546
2-butyl-N-phenylbenzamide
CID 3695058
ethyl 5-[(4-chlorophenyl)carbamoyl]-2-methyl-6-oxo-1H-pyridine-3-carboxylate
CID 46320509
2-chloro-5-[[(2R)-2-ethoxypropanoyl]amino]-N-phenylbenzamide
CID 96550328
2-(butanoylamino)-N-phenylbenzamide
CID 676008
5-ethyl-N-methoxy-2-oxo-6-propyl-1H-pyridine-3-carboxamide
CID 125491199
N-[3-(butanoylamino)phenyl]-2-chlorobenzamide
CID 17187534
2,3-dichloro-N-phenylbenzamide
CID 7732866
N-(4-ethoxyphenyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 66497881

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide?
The IUPAC name of 5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide (CID 125490443) is 5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide is CCCc1[nH]c(=O)c(C(=O)Nc2ccccc2)cc1Cl.
What is the InChIKey of 5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide?
The InChIKey is DJHXIHIPOPELAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-2-6-13-12(16)9-11(15(20)18-13)14(19)17-10-7-4-3-5-8-10/h3-5,7-9H,2,6H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide?
5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide has a molecular weight of 290.75 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-oxo-N-phenyl-6-propyl-1H-pyridine-3-carboxamide is sourced from PubChem (CID 125490443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).