1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol

C18H24N2O — CID 115818131

IUPAC1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol
SMILESCCCn1c(CC(O)C2C3CCCC32)nc2ccccc21
InChIInChI=1S/C18H24N2O/c1-2-10-20-15-9-4-3-8-14(15)19-17(20)11-16(21)18-12-6-5-7-13(12)18/h3-4,8-9,12-13,16,18,21H,2,5-7,10-11H2,1H3
InChIKeyJOSUZSPWZIBKOK-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.40
Rot. Bonds5

About 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol

1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol (PubChem CID 115818131) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol
PubChem CID115818131
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol
SMILESCCCn1c(CC(O)C2C3CCCC32)nc2ccccc21
InChIInChI=1S/C18H24N2O/c1-2-10-20-15-9-4-3-8-14(15)19-17(20)11-16(21)18-12-6-5-7-13(12)18/h3-4,8-9,12-13,16,18,21H,2,5-7,10-11H2,1H3
InChIKeyJOSUZSPWZIBKOK-UHFFFAOYSA-N
XLogP3.40
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol with MolForge

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Related Compounds

1-cyclobutyl-3-(1-propylbenzimidazol-2-yl)propan-2-ol
CID 103170121
1-(3-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol
CID 115818146
1-cyclopropyl-2-(1-propylbenzimidazol-2-yl)ethanamine
CID 79754023
2-[(1-propylbenzimidazol-2-yl)methyl]cyclopentan-1-ol
CID 79750412
3-methoxy-1-(1-propylbenzimidazol-2-yl)butan-2-ol
CID 79753547
1-cyclopropyl-2-[(1-propylbenzimidazol-2-yl)methylamino]ethanol
CID 63299001
1-(dimethylamino)-3-(1-propylbenzimidazol-2-yl)propan-2-ol
CID 79754270
1-propyl-2-[(1-propylbenzimidazol-2-yl)methyl]benzimidazole
CID 102471082
2-(2-piperidin-3-ylpropyl)-1-propylbenzimidazole
CID 81050071
2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol
CID 79755078
1-(oxan-4-yl)-2-(1-propylbenzimidazol-2-yl)ethanamine
CID 79757035
1-(3-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanamine
CID 79757049

Frequently Asked Questions

What is the IUPAC name of 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol?
The IUPAC name of 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol (CID 115818131) is 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol.
What is the SMILES notation for 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol?
The canonical SMILES for 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol is CCCn1c(CC(O)C2C3CCCC32)nc2ccccc21.
What is the InChIKey of 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol?
The InChIKey is JOSUZSPWZIBKOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-2-10-20-15-9-4-3-8-14(15)19-17(20)11-16(21)18-12-6-5-7-13(12)18/h3-4,8-9,12-13,16,18,21H,2,5-7,10-11H2,1H3.
What are the key properties of 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol?
1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol has a molecular weight of 284.40 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol is sourced from PubChem (CID 115818131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).