N-benzyl-2-phenylquinoline-4-carboxamide

C23H18N2O — CID 667698

IUPACN-benzyl-2-phenylquinoline-4-carboxamide
SMILESO=C(NCc1ccccc1)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C23H18N2O/c26-23(24-16-17-9-3-1-4-10-17)20-15-22(18-11-5-2-6-12-18)25-21-14-8-7-13-19(20)21/h1-15H,16H2,(H,24,26)
InChIKeyWFGFEOLNELJISV-UHFFFAOYSA-N
MW338.41 g/mol
LogP4.83
Rot. Bonds4

About N-benzyl-2-phenylquinoline-4-carboxamide

N-benzyl-2-phenylquinoline-4-carboxamide (PubChem CID 667698) has the molecular formula C23H18N2O and a molecular weight of 338.41 g/mol. Its IUPAC name is N-benzyl-2-phenylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-2-phenylquinoline-4-carboxamide
PubChem CID667698
Molecular FormulaC23H18N2O
Molecular Weight338.41 g/mol
Exact Mass338.14
IUPAC NameN-benzyl-2-phenylquinoline-4-carboxamide
SMILESO=C(NCc1ccccc1)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C23H18N2O/c26-23(24-16-17-9-3-1-4-10-17)20-15-22(18-11-5-2-6-12-18)25-21-14-8-7-13-19(20)21/h1-15H,16H2,(H,24,26)
InChIKeyWFGFEOLNELJISV-UHFFFAOYSA-N
XLogP4.83
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-phenylquinoline-4-carboxamide?
The IUPAC name of N-benzyl-2-phenylquinoline-4-carboxamide (CID 667698) is N-benzyl-2-phenylquinoline-4-carboxamide.
What is the SMILES notation for N-benzyl-2-phenylquinoline-4-carboxamide?
The canonical SMILES for N-benzyl-2-phenylquinoline-4-carboxamide is O=C(NCc1ccccc1)c1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of N-benzyl-2-phenylquinoline-4-carboxamide?
The InChIKey is WFGFEOLNELJISV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O/c26-23(24-16-17-9-3-1-4-10-17)20-15-22(18-11-5-2-6-12-18)25-21-14-8-7-13-19(20)21/h1-15H,16H2,(H,24,26).
What are the key properties of N-benzyl-2-phenylquinoline-4-carboxamide?
N-benzyl-2-phenylquinoline-4-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-phenylquinoline-4-carboxamide is sourced from PubChem (CID 667698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).