2-methyl-N,4-diphenylquinoline-3-carboxamide

C23H18N2O — CID 2454634

IUPAC2-methyl-N,4-diphenylquinoline-3-carboxamide
SMILESCc1nc2ccccc2c(-c2ccccc2)c1C(=O)Nc1ccccc1
InChIInChI=1S/C23H18N2O/c1-16-21(23(26)25-18-12-6-3-7-13-18)22(17-10-4-2-5-11-17)19-14-8-9-15-20(19)24-16/h2-15H,1H3,(H,25,26)
InChIKeyGHUYXWCVJTXSIX-UHFFFAOYSA-N
MW338.41 g/mol
LogP5.46
Rot. Bonds3

About 2-methyl-N,4-diphenylquinoline-3-carboxamide

2-methyl-N,4-diphenylquinoline-3-carboxamide (PubChem CID 2454634) has the molecular formula C23H18N2O and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-methyl-N,4-diphenylquinoline-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N,4-diphenylquinoline-3-carboxamide
PubChem CID2454634
Molecular FormulaC23H18N2O
Molecular Weight338.41 g/mol
Exact Mass338.14
IUPAC Name2-methyl-N,4-diphenylquinoline-3-carboxamide
SMILESCc1nc2ccccc2c(-c2ccccc2)c1C(=O)Nc1ccccc1
InChIInChI=1S/C23H18N2O/c1-16-21(23(26)25-18-12-6-3-7-13-18)22(17-10-4-2-5-11-17)19-14-8-9-15-20(19)24-16/h2-15H,1H3,(H,25,26)
InChIKeyGHUYXWCVJTXSIX-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 2-methyl-N,4-diphenylquinoline-3-carboxamide?
The IUPAC name of 2-methyl-N,4-diphenylquinoline-3-carboxamide (CID 2454634) is 2-methyl-N,4-diphenylquinoline-3-carboxamide.
What is the SMILES notation for 2-methyl-N,4-diphenylquinoline-3-carboxamide?
The canonical SMILES for 2-methyl-N,4-diphenylquinoline-3-carboxamide is Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)Nc1ccccc1.
What is the InChIKey of 2-methyl-N,4-diphenylquinoline-3-carboxamide?
The InChIKey is GHUYXWCVJTXSIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O/c1-16-21(23(26)25-18-12-6-3-7-13-18)22(17-10-4-2-5-11-17)19-14-8-9-15-20(19)24-16/h2-15H,1H3,(H,25,26).
What are the key properties of 2-methyl-N,4-diphenylquinoline-3-carboxamide?
2-methyl-N,4-diphenylquinoline-3-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 2-methyl-N,4-diphenylquinoline-3-carboxamide is sourced from PubChem (CID 2454634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).