3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol

C16H30FNO — CID 165491569

IUPAC3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol
SMILESCCC(C)(C)C1CCC(O)CC1N1CCC(F)CC1
InChIInChI=1S/C16H30FNO/c1-4-16(2,3)14-6-5-13(19)11-15(14)18-9-7-12(17)8-10-18/h12-15,19H,4-11H2,1-3H3
InChIKeyGQFLWYKJJPVNAW-UHFFFAOYSA-N
MW271.42 g/mol
LogP3.39
Rot. Bonds3

About 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol

3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol (PubChem CID 165491569) has the molecular formula C16H30FNO and a molecular weight of 271.42 g/mol. Its IUPAC name is 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol
PubChem CID165491569
Molecular FormulaC16H30FNO
Molecular Weight271.42 g/mol
Exact Mass271.23
IUPAC Name3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol
SMILESCCC(C)(C)C1CCC(O)CC1N1CCC(F)CC1
InChIInChI=1S/C16H30FNO/c1-4-16(2,3)14-6-5-13(19)11-15(14)18-9-7-12(17)8-10-18/h12-15,19H,4-11H2,1-3H3
InChIKeyGQFLWYKJJPVNAW-UHFFFAOYSA-N
XLogP3.39
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.42
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol?
The IUPAC name of 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol (CID 165491569) is 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol.
What is the SMILES notation for 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol?
The canonical SMILES for 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol is CCC(C)(C)C1CCC(O)CC1N1CCC(F)CC1.
What is the InChIKey of 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol?
The InChIKey is GQFLWYKJJPVNAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30FNO/c1-4-16(2,3)14-6-5-13(19)11-15(14)18-9-7-12(17)8-10-18/h12-15,19H,4-11H2,1-3H3.
What are the key properties of 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol?
3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol has a molecular weight of 271.42 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 165491569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).