N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide

C17H14N4O2 — CID 140978353

IUPACN-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide
SMILESO=C1CCc2cc(NC(=O)c3nc4ccccc4[nH]3)ccc2N1
InChIInChI=1S/C17H14N4O2/c22-15-8-5-10-9-11(6-7-12(10)19-15)18-17(23)16-20-13-3-1-2-4-14(13)21-16/h1-4,6-7,9H,5,8H2,(H,18,23)(H,19,22)(H,20,21)
InChIKeyUJGPGGITCUIHSG-UHFFFAOYSA-N
MW306.32 g/mol
LogP2.70
Rot. Bonds2

About N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide

N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide (PubChem CID 140978353) has the molecular formula C17H14N4O2 and a molecular weight of 306.32 g/mol. Its IUPAC name is N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide.

Molecular Properties

Compound NameN-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide
PubChem CID140978353
Molecular FormulaC17H14N4O2
Molecular Weight306.32 g/mol
Exact Mass306.11
IUPAC NameN-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide
SMILESO=C1CCc2cc(NC(=O)c3nc4ccccc4[nH]3)ccc2N1
InChIInChI=1S/C17H14N4O2/c22-15-8-5-10-9-11(6-7-12(10)19-15)18-17(23)16-20-13-3-1-2-4-14(13)21-16/h1-4,6-7,9H,5,8H2,(H,18,23)(H,19,22)(H,20,21)
InChIKeyUJGPGGITCUIHSG-UHFFFAOYSA-N
XLogP2.70
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.32
LogP ≤ 52.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)naphthalene-1-carboxamide
CID 40947091
6-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridine-2-carboxamide
CID 62235449
N-(1H-benzimidazol-2-ylmethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 18105228
2-bromo-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)benzamide
CID 27555740
4-fluoro-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)benzamide
CID 18571284
6-oxo-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 60753916
4-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)benzamide
CID 43696909
N-(3-acetylphenyl)-1H-benzimidazole-2-carboxamide
CID 110468819
5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyrazine-2-carboxamide
CID 103817140
N-(1H-benzimidazol-2-yl)-1H-benzimidazole-2-carboxamide
CID 12620222
3,5-dichloro-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-indole-2-carboxamide
CID 55911404
1-(4-chlorophenyl)-3-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)urea
CID 30375883

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide?
The IUPAC name of N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide (CID 140978353) is N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide.
What is the SMILES notation for N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide?
The canonical SMILES for N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide is O=C1CCc2cc(NC(=O)c3nc4ccccc4[nH]3)ccc2N1.
What is the InChIKey of N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide?
The InChIKey is UJGPGGITCUIHSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2/c22-15-8-5-10-9-11(6-7-12(10)19-15)18-17(23)16-20-13-3-1-2-4-14(13)21-16/h1-4,6-7,9H,5,8H2,(H,18,23)(H,19,22)(H,20,21).
What are the key properties of N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide?
N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide has a molecular weight of 306.32 g/mol, XLogP of 2.70, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1H-benzimidazole-2-carboxamide is sourced from PubChem (CID 140978353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).