N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide

C11H13N3O — CID 3149717

IUPACN-[1-(1H-benzimidazol-2-yl)ethyl]acetamide
SMILESCC(=O)NC(C)c1nc2ccccc2[nH]1
InChIInChI=1S/C11H13N3O/c1-7(12-8(2)15)11-13-9-5-3-4-6-10(9)14-11/h3-7H,1-2H3,(H,12,15)(H,13,14)
InChIKeyDQAFWJOMDWZTBB-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.76
Rot. Bonds2

About N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide

N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide (PubChem CID 3149717) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[1-(1H-benzimidazol-2-yl)ethyl]acetamide
PubChem CID3149717
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC NameN-[1-(1H-benzimidazol-2-yl)ethyl]acetamide
SMILESCC(=O)NC(C)c1nc2ccccc2[nH]1
InChIInChI=1S/C11H13N3O/c1-7(12-8(2)15)11-13-9-5-3-4-6-10(9)14-11/h3-7H,1-2H3,(H,12,15)(H,13,14)
InChIKeyDQAFWJOMDWZTBB-UHFFFAOYSA-N
XLogP1.76
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]-2-methylpropanamide
CID 7060732
N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]propanamide
CID 751231
1-[1-(1H-benzimidazol-2-yl)ethyl]-3-propan-2-ylurea
CID 23548549
N-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]-2,2-dimethylpropanamide
CID 751239
propan-2-yl N-[1-(1H-benzimidazol-2-yl)ethyl]carbamate
CID 62668799
2-amino-N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylpropanamide
CID 110460891
2-(4-acetamidophenyl)-N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide
CID 75136988
N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methoxyacetamide
CID 3237629
3-acetamido-3-(1H-benzimidazol-2-yl)propanoic acid
CID 142267067
N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-4-chlorobenzamide
CID 920428
N-[1-(1H-benzimidazol-2-yl)ethyl]-2-propylpentanamide
CID 115532400
2-[1-(1H-benzimidazol-2-yl)ethylamino]propanoic acid
CID 66173148

Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide?
The IUPAC name of N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide (CID 3149717) is N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide?
The canonical SMILES for N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide is CC(=O)NC(C)c1nc2ccccc2[nH]1.
What is the InChIKey of N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide?
The InChIKey is DQAFWJOMDWZTBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-7(12-8(2)15)11-13-9-5-3-4-6-10(9)14-11/h3-7H,1-2H3,(H,12,15)(H,13,14).
What are the key properties of N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide?
N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide has a molecular weight of 203.25 g/mol, XLogP of 1.76, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 3149717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).