2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide

C18H19N3O2 — CID 110791217

IUPAC2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide
SMILESCc1ccc(CC(=O)NCCc2ccc3[nH]c(=O)[nH]c3c2)cc1
InChIInChI=1S/C18H19N3O2/c1-12-2-4-13(5-3-12)11-17(22)19-9-8-14-6-7-15-16(10-14)21-18(23)20-15/h2-7,10H,8-9,11H2,1H3,(H,19,22)(H2,20,21,23)
InChIKeyRADJYNOEIIGPDO-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.07
Rot. Bonds5

About 2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide

2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide (PubChem CID 110791217) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide
PubChem CID110791217
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide
SMILESCc1ccc(CC(=O)NCCc2ccc3[nH]c(=O)[nH]c3c2)cc1
InChIInChI=1S/C18H19N3O2/c1-12-2-4-13(5-3-12)11-17(22)19-9-8-14-6-7-15-16(10-14)21-18(23)20-15/h2-7,10H,8-9,11H2,1H3,(H,19,22)(H2,20,21,23)
InChIKeyRADJYNOEIIGPDO-UHFFFAOYSA-N
XLogP2.07
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide
CID 110791178
N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-thiophen-2-ylacetamide
CID 110791177
N-(2-aminoethyl)-2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 82496271
1-amino-3-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]urea
CID 115192948
1-tert-butyl-3-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]urea
CID 110776173
4-fluoro-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]benzamide
CID 110791167
1-cyano-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]formamide
CID 115172542
N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]-2-phenylacetamide
CID 110785246
N-[(2-methylphenyl)methyl]-2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 110772085
3-[4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanoylamino]propanoic acid
CID 119350958
3-(3-methylphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]propanamide
CID 110785273
methyl 3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanoate
CID 22745227

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide?
The IUPAC name of 2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide (CID 110791217) is 2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide?
The canonical SMILES for 2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide is Cc1ccc(CC(=O)NCCc2ccc3[nH]c(=O)[nH]c3c2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide?
The InChIKey is RADJYNOEIIGPDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-12-2-4-13(5-3-12)11-17(22)19-9-8-14-6-7-15-16(10-14)21-18(23)20-15/h2-7,10H,8-9,11H2,1H3,(H,19,22)(H2,20,21,23).
What are the key properties of 2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide?
2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide has a molecular weight of 309.37 g/mol, XLogP of 2.07, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide is sourced from PubChem (CID 110791217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).