2-acetamido-N-(1H-benzimidazol-2-yl)acetamide

C11H12N4O2 — CID 60652558

IUPAC2-acetamido-N-(1H-benzimidazol-2-yl)acetamide
SMILESCC(=O)NCC(=O)Nc1nc2ccccc2[nH]1
InChIInChI=1S/C11H12N4O2/c1-7(16)12-6-10(17)15-11-13-8-4-2-3-5-9(8)14-11/h2-5H,6H2,1H3,(H,12,16)(H2,13,14,15,17)
InChIKeyJGVRRUBCEMZLSR-UHFFFAOYSA-N
MW232.24 g/mol
LogP0.64
Rot. Bonds3

About 2-acetamido-N-(1H-benzimidazol-2-yl)acetamide

2-acetamido-N-(1H-benzimidazol-2-yl)acetamide (PubChem CID 60652558) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 2-acetamido-N-(1H-benzimidazol-2-yl)acetamide.

Molecular Properties

Compound Name2-acetamido-N-(1H-benzimidazol-2-yl)acetamide
PubChem CID60652558
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name2-acetamido-N-(1H-benzimidazol-2-yl)acetamide
SMILESCC(=O)NCC(=O)Nc1nc2ccccc2[nH]1
InChIInChI=1S/C11H12N4O2/c1-7(16)12-6-10(17)15-11-13-8-4-2-3-5-9(8)14-11/h2-5H,6H2,1H3,(H,12,16)(H2,13,14,15,17)
InChIKeyJGVRRUBCEMZLSR-UHFFFAOYSA-N
XLogP0.64
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1H-benzimidazol-2-ylamino)-2-oxoethyl]-3,3-dimethylbutanamide
CID 60565943
N-[2-(1H-benzimidazol-2-ylamino)-2-oxoethyl]-4-tert-butylbenzamide
CID 9111149
N-[2-(1H-benzimidazol-2-ylamino)-2-oxoethyl]-2-(3-methoxyphenyl)acetamide
CID 53011843
N-[2-(1H-benzimidazol-2-ylamino)-2-oxoethyl]-3-methoxybenzamide
CID 53199724
N-(1H-benzimidazol-2-yl)undecanamide
CID 5093764
N-(1H-benzimidazol-2-yl)-2-(3-methylphenyl)acetamide
CID 62873665
N'-(1H-benzimidazol-2-yl)acetohydrazide
CID 14088792
N-(1H-benzimidazol-2-yl)-3-ethoxypropanamide
CID 63184543
N-(1H-benzimidazol-2-yl)-2-propylsulfonylacetamide
CID 47377841
(2R)-2-acetamido-N-(1H-benzimidazol-2-yl)-3-methylbutanamide
CID 27649319
(3R)-N-[2-(1H-benzimidazol-2-ylamino)-2-oxoethyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 39341801
N-(1H-benzimidazol-2-yl)pent-4-enamide
CID 62867234

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(1H-benzimidazol-2-yl)acetamide?
The IUPAC name of 2-acetamido-N-(1H-benzimidazol-2-yl)acetamide (CID 60652558) is 2-acetamido-N-(1H-benzimidazol-2-yl)acetamide.
What is the SMILES notation for 2-acetamido-N-(1H-benzimidazol-2-yl)acetamide?
The canonical SMILES for 2-acetamido-N-(1H-benzimidazol-2-yl)acetamide is CC(=O)NCC(=O)Nc1nc2ccccc2[nH]1.
What is the InChIKey of 2-acetamido-N-(1H-benzimidazol-2-yl)acetamide?
The InChIKey is JGVRRUBCEMZLSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-7(16)12-6-10(17)15-11-13-8-4-2-3-5-9(8)14-11/h2-5H,6H2,1H3,(H,12,16)(H2,13,14,15,17).
What are the key properties of 2-acetamido-N-(1H-benzimidazol-2-yl)acetamide?
2-acetamido-N-(1H-benzimidazol-2-yl)acetamide has a molecular weight of 232.24 g/mol, XLogP of 0.64, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(1H-benzimidazol-2-yl)acetamide is sourced from PubChem (CID 60652558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).