3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol

C15H28FNO — CID 165499417

IUPAC3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)CC1N1CCC(CF)CC1
InChIInChI=1S/C15H28FNO/c1-2-3-13-4-5-14(18)10-15(13)17-8-6-12(11-16)7-9-17/h12-15,18H,2-11H2,1H3
InChIKeySDMQIHHCSJTIFE-UHFFFAOYSA-N
MW257.39 g/mol
LogP3.00
Rot. Bonds4

About 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol

3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol (PubChem CID 165499417) has the molecular formula C15H28FNO and a molecular weight of 257.39 g/mol. Its IUPAC name is 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol.

Molecular Properties

Compound Name3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol
PubChem CID165499417
Molecular FormulaC15H28FNO
Molecular Weight257.39 g/mol
Exact Mass257.22
IUPAC Name3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)CC1N1CCC(CF)CC1
InChIInChI=1S/C15H28FNO/c1-2-3-13-4-5-14(18)10-15(13)17-8-6-12(11-16)7-9-17/h12-15,18H,2-11H2,1H3
InChIKeySDMQIHHCSJTIFE-UHFFFAOYSA-N
XLogP3.00
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.39
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-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

Related Compounds

(7S)-2-methyl-2-azabicyclo[3.3.1]nonan-7-ol
CID 70245503
1,2-Dimethyldecahydroquinoline-5-ol
CID 13244764
1,2-Dimethyl-cis-decahydroquinolin-5-ol hydrochloride
CID 129789971
3-[3-(Trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol
CID 79618127
3-[4-(Trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol
CID 79618233
3-Fluoro-4-(1-methylpiperidin-3-yl)butan-2-ol
CID 105443903
2-[1-(3-Fluoropropyl)piperidin-2-yl]cyclohexan-1-ol
CID 113569312
2-[1-(2-Fluoroethyl)piperidin-2-yl]cyclohexan-1-ol
CID 114339922
3-[Tert-butyl(ethyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490683
3-[Cyclopropyl(methyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490687
3-[Cyclopropyl(ethyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490688
3-[Methyl(2-methylpropyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490689

Frequently Asked Questions

What is the IUPAC name of 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol?
The IUPAC name of 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol (CID 165499417) is 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol.
What is the SMILES notation for 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol?
The canonical SMILES for 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol is CCCC1CCC(O)CC1N1CCC(CF)CC1.
What is the InChIKey of 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol?
The InChIKey is SDMQIHHCSJTIFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28FNO/c1-2-3-13-4-5-14(18)10-15(13)17-8-6-12(11-16)7-9-17/h12-15,18H,2-11H2,1H3.
What are the key properties of 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol?
3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol has a molecular weight of 257.39 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(fluoromethyl)piperidin-1-yl]-4-propylcyclohexan-1-ol is sourced from PubChem (CID 165499417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).