N-(3H-benzimidazol-5-yl)-N-methylacetamide

C10H11N3O — CID 110869162

IUPACN-(3H-benzimidazol-5-yl)-N-methylacetamide
SMILESCC(=O)N(C)c1ccc2nc[nH]c2c1
InChIInChI=1S/C10H11N3O/c1-7(14)13(2)8-3-4-9-10(5-8)12-6-11-9/h3-6H,1-2H3,(H,11,12)
InChIKeyOCJZQZZVXNBSRM-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.55
Rot. Bonds1

About N-(3H-benzimidazol-5-yl)-N-methylacetamide

N-(3H-benzimidazol-5-yl)-N-methylacetamide (PubChem CID 110869162) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is N-(3H-benzimidazol-5-yl)-N-methylacetamide.

Molecular Properties

Compound NameN-(3H-benzimidazol-5-yl)-N-methylacetamide
PubChem CID110869162
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC NameN-(3H-benzimidazol-5-yl)-N-methylacetamide
SMILESCC(=O)N(C)c1ccc2nc[nH]c2c1
InChIInChI=1S/C10H11N3O/c1-7(14)13(2)8-3-4-9-10(5-8)12-6-11-9/h3-6H,1-2H3,(H,11,12)
InChIKeyOCJZQZZVXNBSRM-UHFFFAOYSA-N
XLogP1.55
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3H-benzimidazol-5-yl(methyl)amino]-2-oxoacetic acid
CID 115141264
N-(3H-benzimidazol-5-yl)-N,3,3-trimethylbutanamide
CID 110869221
N-(3H-benzimidazol-5-yl)-N-methylazetidine-3-carboxamide
CID 115158786
N-(3H-benzimidazol-5-yl)-N-methylcyclobutanecarboxamide
CID 110869220
3-amino-N-(3H-benzimidazol-5-yl)-N-methylbenzamide
CID 115160757
N-(3H-benzimidazol-5-yl)-N-methylpyrrolidine-3-carboxamide
CID 115159458
N-(3H-benzimidazol-5-yl)-N-methyl-2-(4-methylphenoxy)acetamide
CID 110866861
2-[3H-benzimidazol-5-yl(methyl)amino]ethanol
CID 115216158
3-(3H-benzimidazol-5-yl)-N,N-dimethylbenzamide
CID 175533007
N-methyl-N-propan-2-yl-3H-benzimidazole-5-carboxamide
CID 43420531
N-(3-chloropropyl)-N-methyl-3H-benzimidazol-5-amine
CID 115215551
bis(3H-benzimidazol-5-yl)methanone
CID 71332789

Frequently Asked Questions

What is the IUPAC name of N-(3H-benzimidazol-5-yl)-N-methylacetamide?
The IUPAC name of N-(3H-benzimidazol-5-yl)-N-methylacetamide (CID 110869162) is N-(3H-benzimidazol-5-yl)-N-methylacetamide.
What is the SMILES notation for N-(3H-benzimidazol-5-yl)-N-methylacetamide?
The canonical SMILES for N-(3H-benzimidazol-5-yl)-N-methylacetamide is CC(=O)N(C)c1ccc2nc[nH]c2c1.
What is the InChIKey of N-(3H-benzimidazol-5-yl)-N-methylacetamide?
The InChIKey is OCJZQZZVXNBSRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-7(14)13(2)8-3-4-9-10(5-8)12-6-11-9/h3-6H,1-2H3,(H,11,12).
What are the key properties of N-(3H-benzimidazol-5-yl)-N-methylacetamide?
N-(3H-benzimidazol-5-yl)-N-methylacetamide has a molecular weight of 189.22 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3H-benzimidazol-5-yl)-N-methylacetamide is sourced from PubChem (CID 110869162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).