1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol

C11H18N2O — CID 104753089

IUPAC1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol
SMILESCc1nccn1CC(O)C1CCCC1
InChIInChI=1S/C11H18N2O/c1-9-12-6-7-13(9)8-11(14)10-4-2-3-5-10/h6-7,10-11,14H,2-5,8H2,1H3
InChIKeyNXWGMGBFPVDTCC-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.74
Rot. Bonds3

About 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol

1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol (PubChem CID 104753089) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol.

Molecular Properties

Compound Name1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol
PubChem CID104753089
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol
SMILESCc1nccn1CC(O)C1CCCC1
InChIInChI=1S/C11H18N2O/c1-9-12-6-7-13(9)8-11(14)10-4-2-3-5-10/h6-7,10-11,14H,2-5,8H2,1H3
InChIKeyNXWGMGBFPVDTCC-UHFFFAOYSA-N
XLogP1.74
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol?
The IUPAC name of 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol (CID 104753089) is 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol.
What is the SMILES notation for 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol?
The canonical SMILES for 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol is Cc1nccn1CC(O)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol?
The InChIKey is NXWGMGBFPVDTCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9-12-6-7-13(9)8-11(14)10-4-2-3-5-10/h6-7,10-11,14H,2-5,8H2,1H3.
What are the key properties of 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol?
1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol has a molecular weight of 194.28 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol is sourced from PubChem (CID 104753089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).