2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol

C16H30FNO — CID 155302874

IUPAC2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol
SMILESCC(C)C1CCC(CN2CCC(O)CC2CF)CC1
InChIInChI=1S/C16H30FNO/c1-12(2)14-5-3-13(4-6-14)11-18-8-7-16(19)9-15(18)10-17/h12-16,19H,3-11H2,1-2H3
InChIKeyHMVNCOKBZWSFDR-UHFFFAOYSA-N
MW271.42 g/mol
LogP3.24
Rot. Bonds4

About 2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol

2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol (PubChem CID 155302874) has the molecular formula C16H30FNO and a molecular weight of 271.42 g/mol. Its IUPAC name is 2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol
PubChem CID155302874
Molecular FormulaC16H30FNO
Molecular Weight271.42 g/mol
Exact Mass271.23
IUPAC Name2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol
SMILESCC(C)C1CCC(CN2CCC(O)CC2CF)CC1
InChIInChI=1S/C16H30FNO/c1-12(2)14-5-3-13(4-6-14)11-18-8-7-16(19)9-15(18)10-17/h12-16,19H,3-11H2,1-2H3
InChIKeyHMVNCOKBZWSFDR-UHFFFAOYSA-N
XLogP3.24
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.42
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1,5,9-Trimethyl-decyl)-piperidin-4-ol
CID 44271496
4-[[(4S)-1-fluoro-4-propan-2-ylnonan-2-yl]-methylamino]butan-2-ol
CID 126647640
1-[2-(4-Fluorocyclohexyl)ethyl]piperidin-4-ol
CID 140430826
(2R,3R,4R,5S)-1-[[4-(2-fluoropropan-2-yl)cyclohexyl]methyl]-2-methylpiperidine-3,4,5-triol
CID 155286440
(2S,3R,4R,5S)-2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidine-3,4,5-triol
CID 155286557
2-Methyl-1-[[3-(trifluoromethyl)cyclohexyl]methyl]piperidin-4-ol
CID 155302441
2-methyl-1-[[(3R)-3-(trifluoromethyl)cyclohexyl]methyl]piperidin-4-ol
CID 155302491
1-(Cyclohexylmethyl)-2-(fluoromethyl)piperidin-4-ol
CID 155302541
1-[2-(4,4-Difluorocyclohexyl)ethyl]-2-methylpiperidin-4-ol
CID 155302644
2-Methyl-1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol
CID 155302688
1-[(4-Tert-butylcyclohexyl)methyl]-2-(fluoromethyl)piperidin-4-ol
CID 155302702
1-[[4-(2-Fluoropropan-2-yl)cyclohexyl]methyl]-2-methylpiperidin-4-ol
CID 155302745

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol?
The IUPAC name of 2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol (CID 155302874) is 2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol.
What is the SMILES notation for 2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol?
The canonical SMILES for 2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol is CC(C)C1CCC(CN2CCC(O)CC2CF)CC1.
What is the InChIKey of 2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol?
The InChIKey is HMVNCOKBZWSFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30FNO/c1-12(2)14-5-3-13(4-6-14)11-18-8-7-16(19)9-15(18)10-17/h12-16,19H,3-11H2,1-2H3.
What are the key properties of 2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol?
2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol has a molecular weight of 271.42 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-4-ol is sourced from PubChem (CID 155302874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).