[1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol

C18H28FNO — CID 142475224

IUPAC[1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol
SMILESCC(CC(C)(C)c1ccc(F)cc1)N1CCC(CO)CC1
InChIInChI=1S/C18H28FNO/c1-14(20-10-8-15(13-21)9-11-20)12-18(2,3)16-4-6-17(19)7-5-16/h4-7,14-15,21H,8-13H2,1-3H3
InChIKeyOMYIFGAUSNFJNN-UHFFFAOYSA-N
MW293.43 g/mol
LogP3.59
Rot. Bonds5

About [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol

[1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol (PubChem CID 142475224) has the molecular formula C18H28FNO and a molecular weight of 293.43 g/mol. Its IUPAC name is [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol
PubChem CID142475224
Molecular FormulaC18H28FNO
Molecular Weight293.43 g/mol
Exact Mass293.22
IUPAC Name[1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol
SMILESCC(CC(C)(C)c1ccc(F)cc1)N1CCC(CO)CC1
InChIInChI=1S/C18H28FNO/c1-14(20-10-8-15(13-21)9-11-20)12-18(2,3)16-4-6-17(19)7-5-16/h4-7,14-15,21H,8-13H2,1-3H3
InChIKeyOMYIFGAUSNFJNN-UHFFFAOYSA-N
XLogP3.59
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.43
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol 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 [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol?
The IUPAC name of [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol (CID 142475224) is [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol.
What is the SMILES notation for [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol?
The canonical SMILES for [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol is CC(CC(C)(C)c1ccc(F)cc1)N1CCC(CO)CC1.
What is the InChIKey of [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol?
The InChIKey is OMYIFGAUSNFJNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28FNO/c1-14(20-10-8-15(13-21)9-11-20)12-18(2,3)16-4-6-17(19)7-5-16/h4-7,14-15,21H,8-13H2,1-3H3.
What are the key properties of [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol?
[1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol has a molecular weight of 293.43 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[4-(4-fluorophenyl)-4-methylpentan-2-yl]piperidin-4-yl]methanol is sourced from PubChem (CID 142475224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).