6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide

C23H18N2O — CID 67551145

IUPAC6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide
SMILESCc1ccc2nccc(C(=O)Nc3cccc(-c4ccccc4)c3)c2c1
InChIInChI=1S/C23H18N2O/c1-16-10-11-22-21(14-16)20(12-13-24-22)23(26)25-19-9-5-8-18(15-19)17-6-3-2-4-7-17/h2-15H,1H3,(H,25,26)
InChIKeyKQTYZGNTEKHNQH-UHFFFAOYSA-N
MW338.41 g/mol
LogP5.46
Rot. Bonds3

About 6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide

6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide (PubChem CID 67551145) has the molecular formula C23H18N2O and a molecular weight of 338.41 g/mol. Its IUPAC name is 6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide
PubChem CID67551145
Molecular FormulaC23H18N2O
Molecular Weight338.41 g/mol
Exact Mass338.14
IUPAC Name6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide
SMILESCc1ccc2nccc(C(=O)Nc3cccc(-c4ccccc4)c3)c2c1
InChIInChI=1S/C23H18N2O/c1-16-10-11-22-21(14-16)20(12-13-24-22)23(26)25-19-9-5-8-18(15-19)17-6-3-2-4-7-17/h2-15H,1H3,(H,25,26)
InChIKeyKQTYZGNTEKHNQH-UHFFFAOYSA-N
XLogP5.46
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.41
LogP ≤ 55.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide?
The IUPAC name of 6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide (CID 67551145) is 6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide.
What is the SMILES notation for 6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide?
The canonical SMILES for 6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide is Cc1ccc2nccc(C(=O)Nc3cccc(-c4ccccc4)c3)c2c1.
What is the InChIKey of 6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide?
The InChIKey is KQTYZGNTEKHNQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O/c1-16-10-11-22-21(14-16)20(12-13-24-22)23(26)25-19-9-5-8-18(15-19)17-6-3-2-4-7-17/h2-15H,1H3,(H,25,26).
What are the key properties of 6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide?
6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 5.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(3-phenylphenyl)quinoline-4-carboxamide is sourced from PubChem (CID 67551145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).