1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol

C17H30N2O — CID 115819272

IUPAC1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol
SMILESCCCCC1CCC(C(O)Cc2nccn2CC)CC1
InChIInChI=1S/C17H30N2O/c1-3-5-6-14-7-9-15(10-8-14)16(20)13-17-18-11-12-19(17)4-2/h11-12,14-16,20H,3-10,13H2,1-2H3
InChIKeyBWLBXFRKNIAPBN-UHFFFAOYSA-N
MW278.44 g/mol
LogP3.80
Rot. Bonds7

About 1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol

1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol (PubChem CID 115819272) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is 1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol
PubChem CID115819272
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC Name1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol
SMILESCCCCC1CCC(C(O)Cc2nccn2CC)CC1
InChIInChI=1S/C17H30N2O/c1-3-5-6-14-7-9-15(10-8-14)16(20)13-17-18-11-12-19(17)4-2/h11-12,14-16,20H,3-10,13H2,1-2H3
InChIKeyBWLBXFRKNIAPBN-UHFFFAOYSA-N
XLogP3.80
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-ethylimidazol-2-yl)-1-(4-propylcyclohexyl)ethanol
CID 79752753
2-(1-ethylimidazol-2-yl)-1-(4-propylcyclohexyl)ethanamine
CID 79761385
1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanone
CID 115783452
N-[(4-butylcyclohexyl)-(1-ethylimidazol-2-yl)methyl]ethanamine
CID 115860125
1-(4,4-dimethylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanol
CID 79752511
4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine
CID 105009415
1-(2,2-dimethylcyclopropyl)-2-(1-ethylimidazol-2-yl)ethanol
CID 107005397
2-(1-methylimidazol-2-yl)-1-[4-(trifluoromethyl)cyclohexyl]ethanol
CID 105113600
1-(4-butylcyclohexyl)-2-(1-methylpyrazol-4-yl)ethanol
CID 115780399
1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 79761510
2-(5-bromo-2-pyridinyl)-1-(4-butylcyclohexyl)ethanol
CID 115833225
N-ethyl-1-(3-ethylcyclopentyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 79761771

Frequently Asked Questions

What is the IUPAC name of 1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol?
The IUPAC name of 1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol (CID 115819272) is 1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol.
What is the SMILES notation for 1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol?
The canonical SMILES for 1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol is CCCCC1CCC(C(O)Cc2nccn2CC)CC1.
What is the InChIKey of 1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol?
The InChIKey is BWLBXFRKNIAPBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O/c1-3-5-6-14-7-9-15(10-8-14)16(20)13-17-18-11-12-19(17)4-2/h11-12,14-16,20H,3-10,13H2,1-2H3.
What are the key properties of 1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol?
1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol has a molecular weight of 278.44 g/mol, XLogP of 3.80, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol is sourced from PubChem (CID 115819272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).