N-quinolin-6-ylbenzamide

C16H12N2O — CID 833617

IUPACN-quinolin-6-ylbenzamide
SMILESO=C(Nc1ccc2ncccc2c1)c1ccccc1
InChIInChI=1S/C16H12N2O/c19-16(12-5-2-1-3-6-12)18-14-8-9-15-13(11-14)7-4-10-17-15/h1-11H,(H,18,19)
InChIKeyWQBDHSKBYRWNNN-UHFFFAOYSA-N
MW248.28 g/mol
LogP3.49
Rot. Bonds2

About N-quinolin-6-ylbenzamide

N-quinolin-6-ylbenzamide (PubChem CID 833617) has the molecular formula C16H12N2O and a molecular weight of 248.28 g/mol. Its IUPAC name is N-quinolin-6-ylbenzamide.

Molecular Properties

Compound NameN-quinolin-6-ylbenzamide
PubChem CID833617
Molecular FormulaC16H12N2O
Molecular Weight248.28 g/mol
Exact Mass248.09
IUPAC NameN-quinolin-6-ylbenzamide
SMILESO=C(Nc1ccc2ncccc2c1)c1ccccc1
InChIInChI=1S/C16H12N2O/c19-16(12-5-2-1-3-6-12)18-14-8-9-15-13(11-14)7-4-10-17-15/h1-11H,(H,18,19)
InChIKeyWQBDHSKBYRWNNN-UHFFFAOYSA-N
XLogP3.49
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-quinolin-6-ylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-dibromo-N-quinolin-6-ylbenzamide
CID 107980427
N-quinolin-6-yl-3-sulfanylbenzamide
CID 107028522
N-quinolin-6-yl-2H-benzotriazole-5-carboxamide
CID 60555981
6-amino-N-quinolin-6-ylpyridine-3-carboxamide
CID 62642214
N-pyridin-4-ylquinoline-6-carboxamide
CID 53313330
2-hydrazinyl-N-quinolin-6-ylpyridine-4-carboxamide
CID 62640418
2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide
CID 62640761
N,N'-di(quinolin-6-yl)propanediamide
CID 2837594
N-(4-iodophenyl)quinoline-6-carboxamide
CID 60723213
4-acetyl-N-quinolin-6-yl-1H-pyrrole-2-carboxamide
CID 60555786
4-(3,5-dimethoxybenzoyl)-N-quinolin-6-ylbenzamide;hydrochloride
CID 90485217
N-(3-amino-4-bromophenyl)quinoline-6-carboxamide
CID 79754299

Frequently Asked Questions

What is the IUPAC name of N-quinolin-6-ylbenzamide?
The IUPAC name of N-quinolin-6-ylbenzamide (CID 833617) is N-quinolin-6-ylbenzamide.
What is the SMILES notation for N-quinolin-6-ylbenzamide?
The canonical SMILES for N-quinolin-6-ylbenzamide is O=C(Nc1ccc2ncccc2c1)c1ccccc1.
What is the InChIKey of N-quinolin-6-ylbenzamide?
The InChIKey is WQBDHSKBYRWNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O/c19-16(12-5-2-1-3-6-12)18-14-8-9-15-13(11-14)7-4-10-17-15/h1-11H,(H,18,19).
What are the key properties of N-quinolin-6-ylbenzamide?
N-quinolin-6-ylbenzamide has a molecular weight of 248.28 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinolin-6-ylbenzamide is sourced from PubChem (CID 833617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).