N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide

C17H17N3O2 — CID 110791178

IUPACN-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCCc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C17H17N3O2/c21-16(11-12-4-2-1-3-5-12)18-9-8-13-6-7-14-15(10-13)20-17(22)19-14/h1-7,10H,8-9,11H2,(H,18,21)(H2,19,20,22)
InChIKeyXMLAIRSVEXUBFO-UHFFFAOYSA-N
MW295.34 g/mol
LogP1.76
Rot. Bonds5

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

N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide (PubChem CID 110791178) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide
PubChem CID110791178
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC NameN-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCCc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C17H17N3O2/c21-16(11-12-4-2-1-3-5-12)18-9-8-13-6-7-14-15(10-13)20-17(22)19-14/h1-7,10H,8-9,11H2,(H,18,21)(H2,19,20,22)
InChIKeyXMLAIRSVEXUBFO-UHFFFAOYSA-N
XLogP1.76
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 51.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methylphenyl)-N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide
CID 110791217
N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]-2-phenylacetamide
CID 110785246
N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-thiophen-2-ylacetamide
CID 110791177
5-(2-oxo-3-phenylpropyl)-1,3-dihydrobenzimidazol-2-one
CID 158499935
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
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
3-[4-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanoylamino]propanoic acid
CID 119350958
1-benzyl-3-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]urea
CID 110775421
2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-N-phenylacetamide
CID 110772142
N-[2-(2-methyl-3H-benzimidazol-5-yl)ethyl]-2-phenylacetamide
CID 110791481

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide?
The IUPAC name of N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide (CID 110791178) is N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide is O=C(Cc1ccccc1)NCCc1ccc2[nH]c(=O)[nH]c2c1.
What is the InChIKey of N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide?
The InChIKey is XMLAIRSVEXUBFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c21-16(11-12-4-2-1-3-5-12)18-9-8-13-6-7-14-15(10-13)20-17(22)19-14/h1-7,10H,8-9,11H2,(H,18,21)(H2,19,20,22).
What are the key properties of N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide?
N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide has a molecular weight of 295.34 g/mol, XLogP of 1.76, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-2-phenylacetamide is sourced from PubChem (CID 110791178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).