1-cyclopropyl-N-methylbenzimidazol-2-amine

C11H13N3 — CID 21043921

IUPAC1-cyclopropyl-N-methylbenzimidazol-2-amine
SMILESCNc1nc2ccccc2n1C1CC1
InChIInChI=1S/C11H13N3/c1-12-11-13-9-4-2-3-5-10(9)14(11)8-6-7-8/h2-5,8H,6-7H2,1H3,(H,12,13)
InChIKeyVLXZZUMKUFVDKD-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.41
Rot. Bonds2

About 1-cyclopropyl-N-methylbenzimidazol-2-amine

1-cyclopropyl-N-methylbenzimidazol-2-amine (PubChem CID 21043921) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 1-cyclopropyl-N-methylbenzimidazol-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-methylbenzimidazol-2-amine
PubChem CID21043921
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name1-cyclopropyl-N-methylbenzimidazol-2-amine
SMILESCNc1nc2ccccc2n1C1CC1
InChIInChI=1S/C11H13N3/c1-12-11-13-9-4-2-3-5-10(9)14(11)8-6-7-8/h2-5,8H,6-7H2,1H3,(H,12,13)
InChIKeyVLXZZUMKUFVDKD-UHFFFAOYSA-N
XLogP2.41
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(thian-3-yl)benzimidazol-2-amine
CID 155348691
1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine
CID 43142730
N-(1-cyclohexylbenzimidazol-2-yl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119732157
1-cyclopropyl-2-(2-methylpyrrolidin-3-yl)benzimidazole
CID 79364147
1-[(1-cyclopropylbenzimidazol-2-yl)methyl]-N-methylcyclohexan-1-amine
CID 65243114
N-[2-[(1-cyclohexylbenzimidazol-2-yl)amino]-2-oxoethyl]propanamide
CID 47078417
1-cyclopropylbenzimidazole-2-carbaldehyde;hydrate;hydrochloride
CID 86624645
2-(4-acetamidophenyl)-N-(1-cyclopentylbenzimidazol-2-yl)acetamide
CID 136527419
sodium 1-cyclopropylbenzimidazole-2-carboxylate
CID 131637596
4-amino-N-(1-cyclohexylbenzimidazol-2-yl)pentanamide;hydrochloride
CID 120560614
N-(1-cyclopentylbenzimidazol-2-yl)-2-methylpyridine-4-carboxamide
CID 136538090
4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide
CID 73051604

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-methylbenzimidazol-2-amine?
The IUPAC name of 1-cyclopropyl-N-methylbenzimidazol-2-amine (CID 21043921) is 1-cyclopropyl-N-methylbenzimidazol-2-amine.
What is the SMILES notation for 1-cyclopropyl-N-methylbenzimidazol-2-amine?
The canonical SMILES for 1-cyclopropyl-N-methylbenzimidazol-2-amine is CNc1nc2ccccc2n1C1CC1.
What is the InChIKey of 1-cyclopropyl-N-methylbenzimidazol-2-amine?
The InChIKey is VLXZZUMKUFVDKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-12-11-13-9-4-2-3-5-10(9)14(11)8-6-7-8/h2-5,8H,6-7H2,1H3,(H,12,13).
What are the key properties of 1-cyclopropyl-N-methylbenzimidazol-2-amine?
1-cyclopropyl-N-methylbenzimidazol-2-amine has a molecular weight of 187.25 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-methylbenzimidazol-2-amine is sourced from PubChem (CID 21043921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).