2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide

C22H24N4O3 — CID 46419716

IUPAC2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
SMILESCCn1c(=O)n(CC(=O)Nc2ccccc2C(=O)N2CCCC2)c2ccccc21
InChIInChI=1S/C22H24N4O3/c1-2-25-18-11-5-6-12-19(18)26(22(25)29)15-20(27)23-17-10-4-3-9-16(17)21(28)24-13-7-8-14-24/h3-6,9-12H,2,7-8,13-15H2,1H3,(H,23,27)
InChIKeyGLFUUBBSOWVQEU-UHFFFAOYSA-N
MW392.46 g/mol
LogP2.70
Rot. Bonds5

About 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide

2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide (PubChem CID 46419716) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
PubChem CID46419716
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC Name2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
SMILESCCn1c(=O)n(CC(=O)Nc2ccccc2C(=O)N2CCCC2)c2ccccc21
InChIInChI=1S/C22H24N4O3/c1-2-25-18-11-5-6-12-19(18)26(22(25)29)15-20(27)23-17-10-4-3-9-16(17)21(28)24-13-7-8-14-24/h3-6,9-12H,2,7-8,13-15H2,1H3,(H,23,27)
InChIKeyGLFUUBBSOWVQEU-UHFFFAOYSA-N
XLogP2.70
TPSA76.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-ethyl-2,4-dioxoquinazolin-1-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 35278255
N-[4-chloro-2-(pyrrolidine-1-carbonyl)phenyl]-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
CID 47037114
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-(2-piperidin-1-ylsulfonylphenyl)acetamide
CID 52662712
N-[2-(piperidine-1-carbonyl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 35275235
N-[2-(pyrrolidine-1-carbonyl)phenyl]pentanamide
CID 30336776
2-(1,3-dioxoisoindol-2-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 1223346
N-[2-(piperidine-1-carbonyl)phenyl]hexanamide
CID 4953779
methyl 1-[2-oxo-2-[2-(pyrrolidine-1-carbonyl)anilino]ethyl]indole-3-carboxylate
CID 46419706
N-[2-(azepane-1-carbonyl)phenyl]octanamide
CID 4958626
methyl 2-[[2-(3-methyl-2-oxobenzimidazol-1-yl)acetyl]amino]benzoate
CID 26067711
2-amino-N-[2-(piperidine-1-carbonyl)phenyl]acetamide;hydrochloride
CID 119268834
N,N'-bis[2-(piperidine-1-carbonyl)phenyl]decanediamide
CID 17080136

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide (CID 46419716) is 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide is CCn1c(=O)n(CC(=O)Nc2ccccc2C(=O)N2CCCC2)c2ccccc21.
What is the InChIKey of 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide?
The InChIKey is GLFUUBBSOWVQEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-2-25-18-11-5-6-12-19(18)26(22(25)29)15-20(27)23-17-10-4-3-9-16(17)21(28)24-13-7-8-14-24/h3-6,9-12H,2,7-8,13-15H2,1H3,(H,23,27).
What are the key properties of 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide?
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide has a molecular weight of 392.46 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide is sourced from PubChem (CID 46419716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).