1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide

C11H11N3O — CID 91134350

IUPAC1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide
SMILESNC(=O)C1(c2nc3ccccc3[nH]2)CC1
InChIInChI=1S/C11H11N3O/c12-9(15)11(5-6-11)10-13-7-3-1-2-4-8(7)14-10/h1-4H,5-6H2,(H2,12,15)(H,13,14)
InChIKeyLETPMWXZROFZLR-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.08
Rot. Bonds2

About 1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide

1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide (PubChem CID 91134350) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is 1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide
PubChem CID91134350
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC Name1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide
SMILESNC(=O)C1(c2nc3ccccc3[nH]2)CC1
InChIInChI=1S/C11H11N3O/c12-9(15)11(5-6-11)10-13-7-3-1-2-4-8(7)14-10/h1-4H,5-6H2,(H2,12,15)(H,13,14)
InChIKeyLETPMWXZROFZLR-UHFFFAOYSA-N
XLogP1.08
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 3-(1H-benzimidazol-2-yl)oxetane-3-carboxylate
CID 116985512
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CID 22240874
(2R)-2-(1H-benzimidazol-2-yl)-1-propanoylpyrrolidine-2-carboxamide
CID 69260201
2-(1-methylcyclooctyl)-1H-benzimidazole
CID 173176716
2-(2-methylazetidin-2-yl)-1H-benzimidazole
CID 141153075
1-[4-(1H-benzimidazol-2-yl)phenyl]cyclopropane-1-carboxylic acid
CID 167313683
1-(6-methyl-1H-benzimidazol-2-yl)cyclopropane-1-carboxylic acid
CID 83857720
trans-(1R,3R)-5-(1H-benzimidazol-2-yl)cyclohexane-1,2,3,5-tetrol;hydrate
CID 139077353
[1-(1H-benzimidazol-2-yl)-4-methylcyclohexyl]methanamine
CID 113310412
1-(1H-benzimidazol-2-yl)-1-sulfanylurea
CID 87929261
N-(1H-benzimidazol-2-yl)-1-carbamothioylcyclopentane-1-carboxamide
CID 63563740

Frequently Asked Questions

What is the IUPAC name of 1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide (CID 91134350) is 1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide is NC(=O)C1(c2nc3ccccc3[nH]2)CC1.
What is the InChIKey of 1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide?
The InChIKey is LETPMWXZROFZLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c12-9(15)11(5-6-11)10-13-7-3-1-2-4-8(7)14-10/h1-4H,5-6H2,(H2,12,15)(H,13,14).
What are the key properties of 1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide?
1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide has a molecular weight of 201.23 g/mol, XLogP of 1.08, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-benzimidazol-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 91134350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).