N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide

C23H17ClN2O2 — CID 66497391

IUPACN-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)c1ccc(-c2ccc3ccccc3c2)[nH]c1=O
InChIInChI=1S/C23H17ClN2O2/c1-14-6-9-18(24)13-21(14)26-23(28)19-10-11-20(25-22(19)27)17-8-7-15-4-2-3-5-16(15)12-17/h2-13H,1H3,(H,25,27)(H,26,28)
InChIKeyCMKPSTWKQGQSTM-UHFFFAOYSA-N
MW388.85 g/mol
LogP5.41
Rot. Bonds3

About N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide

N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 66497391) has the molecular formula C23H17ClN2O2 and a molecular weight of 388.85 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID66497391
Molecular FormulaC23H17ClN2O2
Molecular Weight388.85 g/mol
Exact Mass388.10
IUPAC NameN-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)c1ccc(-c2ccc3ccccc3c2)[nH]c1=O
InChIInChI=1S/C23H17ClN2O2/c1-14-6-9-18(24)13-21(14)26-23(28)19-10-11-20(25-22(19)27)17-8-7-15-4-2-3-5-16(15)12-17/h2-13H,1H3,(H,25,27)(H,26,28)
InChIKeyCMKPSTWKQGQSTM-UHFFFAOYSA-N
XLogP5.41
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.85
LogP ≤ 55.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide (CID 66497391) is N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc(Cl)cc1NC(=O)c1ccc(-c2ccc3ccccc3c2)[nH]c1=O.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is CMKPSTWKQGQSTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17ClN2O2/c1-14-6-9-18(24)13-21(14)26-23(28)19-10-11-20(25-22(19)27)17-8-7-15-4-2-3-5-16(15)12-17/h2-13H,1H3,(H,25,27)(H,26,28).
What are the key properties of N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide?
N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 388.85 g/mol, XLogP of 5.41, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 66497391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).