N-(2-methylquinolin-8-yl)-3-phenylbenzamide

C23H18N2O — CID 171473806

IUPACN-(2-methylquinolin-8-yl)-3-phenylbenzamide
SMILESCc1ccc2cccc(NC(=O)c3cccc(-c4ccccc4)c3)c2n1
InChIInChI=1S/C23H18N2O/c1-16-13-14-18-9-6-12-21(22(18)24-16)25-23(26)20-11-5-10-19(15-20)17-7-3-2-4-8-17/h2-15H,1H3,(H,25,26)
InChIKeyVIZGTDKYKNCKPM-UHFFFAOYSA-N
MW338.41 g/mol
LogP5.46
Rot. Bonds3

About N-(2-methylquinolin-8-yl)-3-phenylbenzamide

N-(2-methylquinolin-8-yl)-3-phenylbenzamide (PubChem CID 171473806) has the molecular formula C23H18N2O and a molecular weight of 338.41 g/mol. Its IUPAC name is N-(2-methylquinolin-8-yl)-3-phenylbenzamide.

Molecular Properties

Compound NameN-(2-methylquinolin-8-yl)-3-phenylbenzamide
PubChem CID171473806
Molecular FormulaC23H18N2O
Molecular Weight338.41 g/mol
Exact Mass338.14
IUPAC NameN-(2-methylquinolin-8-yl)-3-phenylbenzamide
SMILESCc1ccc2cccc(NC(=O)c3cccc(-c4ccccc4)c3)c2n1
InChIInChI=1S/C23H18N2O/c1-16-13-14-18-9-6-12-21(22(18)24-16)25-23(26)20-11-5-10-19(15-20)17-7-3-2-4-8-17/h2-15H,1H3,(H,25,26)
InChIKeyVIZGTDKYKNCKPM-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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Related Compounds

3-acetamido-N-(2-methylquinolin-8-yl)benzamide
CID 110745574
2-hydroxy-N-(2-methylquinolin-8-yl)benzamide
CID 62954992
5-bromo-N-(2-methylquinolin-8-yl)pyridine-3-carboxamide
CID 62954817
4-(ethylamino)-N-(2-methylquinolin-8-yl)benzamide
CID 118902356
6-amino-N-(2-methylquinolin-8-yl)pyridine-3-carboxamide
CID 62953787
N-(2-methylquinolin-8-yl)-1-benzofuran-2-carboxamide
CID 2996037
3-fluoro-N-(2-methylquinolin-8-yl)-4-sulfamoylbenzamide
CID 167785991
3-[(2-methylquinolin-8-yl)amino]-3-oxopropanoic acid
CID 62953963
4-bromo-N-(2-methylquinolin-8-yl)-1H-pyrrole-2-carboxamide
CID 62954640
5-bromo-2,3,4-trimethyl-N-(2-methylquinolin-8-yl)benzamide
CID 23833429
N-(2-methylquinolin-8-yl)pyrene-1-carboxamide
CID 168859940
6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide
CID 103337437

Frequently Asked Questions

What is the IUPAC name of N-(2-methylquinolin-8-yl)-3-phenylbenzamide?
The IUPAC name of N-(2-methylquinolin-8-yl)-3-phenylbenzamide (CID 171473806) is N-(2-methylquinolin-8-yl)-3-phenylbenzamide.
What is the SMILES notation for N-(2-methylquinolin-8-yl)-3-phenylbenzamide?
The canonical SMILES for N-(2-methylquinolin-8-yl)-3-phenylbenzamide is Cc1ccc2cccc(NC(=O)c3cccc(-c4ccccc4)c3)c2n1.
What is the InChIKey of N-(2-methylquinolin-8-yl)-3-phenylbenzamide?
The InChIKey is VIZGTDKYKNCKPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O/c1-16-13-14-18-9-6-12-21(22(18)24-16)25-23(26)20-11-5-10-19(15-20)17-7-3-2-4-8-17/h2-15H,1H3,(H,25,26).
What are the key properties of N-(2-methylquinolin-8-yl)-3-phenylbenzamide?
N-(2-methylquinolin-8-yl)-3-phenylbenzamide 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 N-(2-methylquinolin-8-yl)-3-phenylbenzamide is sourced from PubChem (CID 171473806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).