N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide

C21H18N4O2 — CID 46969013

IUPACN-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
SMILESCCn1cnc2cc(NC(=O)c3ccc(-c4ccccc4)[nH]c3=O)ccc21
InChIInChI=1S/C21H18N4O2/c1-2-25-13-22-18-12-15(8-11-19(18)25)23-20(26)16-9-10-17(24-21(16)27)14-6-4-3-5-7-14/h3-13H,2H2,1H3,(H,23,26)(H,24,27)
InChIKeyIRUWVTDLWXJQED-UHFFFAOYSA-N
MW358.40 g/mol
LogP3.66
Rot. Bonds4

About N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide

N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide (PubChem CID 46969013) has the molecular formula C21H18N4O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
PubChem CID46969013
Molecular FormulaC21H18N4O2
Molecular Weight358.40 g/mol
Exact Mass358.14
IUPAC NameN-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
SMILESCCn1cnc2cc(NC(=O)c3ccc(-c4ccccc4)[nH]c3=O)ccc21
InChIInChI=1S/C21H18N4O2/c1-2-25-13-22-18-12-15(8-11-19(18)25)23-20(26)16-9-10-17(24-21(16)27)14-6-4-3-5-7-14/h3-13H,2H2,1H3,(H,23,26)(H,24,27)
InChIKeyIRUWVTDLWXJQED-UHFFFAOYSA-N
XLogP3.66
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-ethoxyphenyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 66497881
2-oxo-6-phenyl-N-(4-propylphenyl)-1H-pyridine-3-carboxamide
CID 112830494
N-(1-ethylbenzimidazol-5-yl)thiophene-2-carboxamide
CID 828717
N-(3,4-difluorophenyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 66497927
N-(1-ethylbenzimidazol-5-yl)butanamide
CID 2973046
2-oxo-6-phenyl-N-(1H-pyrazol-4-yl)-1H-pyridine-3-carboxamide
CID 60506694
N-[3-[(1S)-1-methoxyethyl]phenyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 95290166
butyl 4-[(2-oxo-6-phenyl-1H-pyridine-3-carbonyl)amino]benzoate
CID 66497900
2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide
CID 82521335
N-(2-ethylphenyl)-2-oxo-6-(4-phenylphenyl)-1H-pyridine-3-carboxamide
CID 66498057
N-(3-chloro-4-fluorophenyl)-2-oxo-6-(4-phenylphenyl)-1H-pyridine-3-carboxamide
CID 66498018
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 55755898

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
The IUPAC name of N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide (CID 46969013) is N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide is CCn1cnc2cc(NC(=O)c3ccc(-c4ccccc4)[nH]c3=O)ccc21.
What is the InChIKey of N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
The InChIKey is IRUWVTDLWXJQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O2/c1-2-25-13-22-18-12-15(8-11-19(18)25)23-20(26)16-9-10-17(24-21(16)27)14-6-4-3-5-7-14/h3-13H,2H2,1H3,(H,23,26)(H,24,27).
What are the key properties of N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide has a molecular weight of 358.40 g/mol, XLogP of 3.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylbenzimidazol-5-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide is sourced from PubChem (CID 46969013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).