N-(benzimidazol-1-yl)acetamide

C9H9N3O — CID 2318657

IUPACN-(benzimidazol-1-yl)acetamide
SMILESCC(=O)Nn1cnc2ccccc21
InChIInChI=1S/C9H9N3O/c1-7(13)11-12-6-10-8-4-2-3-5-9(8)12/h2-6H,1H3,(H,11,13)
InChIKeyWFAQRNLVTGMJGE-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.13
Rot. Bonds1

About N-(benzimidazol-1-yl)acetamide

N-(benzimidazol-1-yl)acetamide (PubChem CID 2318657) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is N-(benzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(benzimidazol-1-yl)acetamide
PubChem CID2318657
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC NameN-(benzimidazol-1-yl)acetamide
SMILESCC(=O)Nn1cnc2ccccc21
InChIInChI=1S/C9H9N3O/c1-7(13)11-12-6-10-8-4-2-3-5-9(8)12/h2-6H,1H3,(H,11,13)
InChIKeyWFAQRNLVTGMJGE-UHFFFAOYSA-N
XLogP1.13
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

benzimidazol-1-ylcarbamic acid
CID 21218422
N-(benzimidazol-1-yl)-3-oxobutanamide
CID 87961400
2-(benzimidazol-1-ylcarbamoyl)benzoic acid
CID 134107318
N-(benzimidazol-1-yl)-2-bromobenzamide
CID 24535711
N-(benzimidazol-1-yl)-2-methylsulfonylbenzamide
CID 34338436
3-acetamido-N-(benzimidazol-1-yl)-3-(4-chlorophenyl)propanamide
CID 42931709
1-(benzimidazol-1-yl)-3-[(1R)-1-pyridin-2-ylethyl]urea
CID 36524001
(2S,3S)-N-(benzimidazol-1-yl)-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 34338697
N-(benzimidazol-1-yl)-3-phenylsulfanylpropanamide
CID 34327055
N-(benzimidazol-1-yl)-5-chlorothiophene-2-carboxamide
CID 34328272
(E)-N-(benzimidazol-1-yl)-3-(3,4-dichlorophenyl)prop-2-enamide
CID 34329231
N-(benzimidazol-1-yl)-3,4-diethoxybenzamide
CID 24535717

Frequently Asked Questions

What is the IUPAC name of N-(benzimidazol-1-yl)acetamide?
The IUPAC name of N-(benzimidazol-1-yl)acetamide (CID 2318657) is N-(benzimidazol-1-yl)acetamide.
What is the SMILES notation for N-(benzimidazol-1-yl)acetamide?
The canonical SMILES for N-(benzimidazol-1-yl)acetamide is CC(=O)Nn1cnc2ccccc21.
What is the InChIKey of N-(benzimidazol-1-yl)acetamide?
The InChIKey is WFAQRNLVTGMJGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c1-7(13)11-12-6-10-8-4-2-3-5-9(8)12/h2-6H,1H3,(H,11,13).
What are the key properties of N-(benzimidazol-1-yl)acetamide?
N-(benzimidazol-1-yl)acetamide has a molecular weight of 175.19 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzimidazol-1-yl)acetamide is sourced from PubChem (CID 2318657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).