2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole

C18H18N2 — CID 134835912

IUPAC2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole
SMILESCc1ccc2nc(C3CC3)n(-c3ccccc3C)c2c1
InChIInChI=1S/C18H18N2/c1-12-7-10-15-17(11-12)20(18(19-15)14-8-9-14)16-6-4-3-5-13(16)2/h3-7,10-11,14H,8-9H2,1-2H3
InChIKeyRMBLCCPBRVYCDA-UHFFFAOYSA-N
MW262.36 g/mol
LogP4.52
Rot. Bonds2

About 2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole

2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole (PubChem CID 134835912) has the molecular formula C18H18N2 and a molecular weight of 262.36 g/mol. Its IUPAC name is 2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole.

Molecular Properties

Compound Name2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole
PubChem CID134835912
Molecular FormulaC18H18N2
Molecular Weight262.36 g/mol
Exact Mass262.15
IUPAC Name2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole
SMILESCc1ccc2nc(C3CC3)n(-c3ccccc3C)c2c1
InChIInChI=1S/C18H18N2/c1-12-7-10-15-17(11-12)20(18(19-15)14-8-9-14)16-6-4-3-5-13(16)2/h3-7,10-11,14H,8-9H2,1-2H3
InChIKeyRMBLCCPBRVYCDA-UHFFFAOYSA-N
XLogP4.52
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-cyclopropylbenzimidazol-1-yl)-2-methylbenzaldehyde
CID 87280714
2-cyclopropyl-1-[(2,5-dimethylphenyl)methyl]benzimidazole
CID 18878588
2-cyclobutyl-1-(4-methylphenyl)benzimidazole
CID 7996379
5-methyl-1-(2-methylphenyl)benzimidazol-2-amine
CID 43661880
(2R,13R)-8-methyl-4,11-diazaheptacyclo[12.6.6.02,13.03,11.05,10.015,20.021,26]hexacosa-3,5(10),6,8,15,17,19,21,23,25-decaen-12-one
CID 1214706
6-chloro-1-(2-methylphenyl)benzimidazol-2-amine
CID 115470391
1-(4-bromo-2-methylphenyl)-2-cyclopropylbenzimidazol-5-amine
CID 63497745
2-[3,5-bis[1-(2-methylphenyl)benzimidazol-2-yl]phenyl]-1-(2-methylphenyl)benzimidazole
CID 23399455
1-(2-methylphenyl)-2-[10-(4-methylphenyl)anthracen-9-yl]benzimidazole
CID 89265079
3-(2-methylphenyl)-2-(oxolan-3-yl)imidazo[4,5-b]pyridine
CID 117160516
4-bromo-2,6-dimethyl-1-(2-methylphenyl)benzimidazole
CID 134857704
3-(2-methylphenyl)-2-(thiolan-2-yl)imidazo[4,5-b]pyridine
CID 117162624

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole?
The IUPAC name of 2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole (CID 134835912) is 2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole.
What is the SMILES notation for 2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole?
The canonical SMILES for 2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole is Cc1ccc2nc(C3CC3)n(-c3ccccc3C)c2c1.
What is the InChIKey of 2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole?
The InChIKey is RMBLCCPBRVYCDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2/c1-12-7-10-15-17(11-12)20(18(19-15)14-8-9-14)16-6-4-3-5-13(16)2/h3-7,10-11,14H,8-9H2,1-2H3.
What are the key properties of 2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole?
2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole has a molecular weight of 262.36 g/mol, XLogP of 4.52, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-methyl-1-(2-methylphenyl)benzimidazole is sourced from PubChem (CID 134835912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).