2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol

C17H25FN2O — CID 62610058

IUPAC2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol
SMILESOC1CCCCC1CN1CCN(c2ccc(F)cc2)CC1
InChIInChI=1S/C17H25FN2O/c18-15-5-7-16(8-6-15)20-11-9-19(10-12-20)13-14-3-1-2-4-17(14)21/h5-8,14,17,21H,1-4,9-13H2
InChIKeyGTZACQFZTWIBRX-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.50
Rot. Bonds3

About 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol

2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol (PubChem CID 62610058) has the molecular formula C17H25FN2O and a molecular weight of 292.40 g/mol. Its IUPAC name is 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol
PubChem CID62610058
Molecular FormulaC17H25FN2O
Molecular Weight292.40 g/mol
Exact Mass292.20
IUPAC Name2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol
SMILESOC1CCCCC1CN1CCN(c2ccc(F)cc2)CC1
InChIInChI=1S/C17H25FN2O/c18-15-5-7-16(8-6-15)20-11-9-19(10-12-20)13-14-3-1-2-4-17(14)21/h5-8,14,17,21H,1-4,9-13H2
InChIKeyGTZACQFZTWIBRX-UHFFFAOYSA-N
XLogP2.50
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]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

Related Compounds

2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]azepane
CID 64569761
4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]oxolan-3-amine
CID 66236106
1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]piperidin-4-ol
CID 28957837
2-(pyrrolidin-1-ylmethyl)cycloheptan-1-ol
CID 51345852
4-(4-fluorophenyl)-N'-[(2-hydroxycyclopentyl)methyl]piperazine-1-carboximidamide
CID 111802822
1-(4-fluorophenyl)-4-[[(4R)-4-methylpyrrolidin-3-yl]methyl]-1,4-diazepane
CID 142524325
cyclopentyl-[3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-4-phenylpyrrolidin-1-yl]methanone
CID 46062658
(2S)-1-cyclopentyloxy-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol
CID 42588067
4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol;bis(2,2,2-trifluoroacetic acid)
CID 154924391
[(3R,4R)-1-[1-(4-fluorophenyl)piperidin-4-yl]-4-[(4-methylpiperazin-1-yl)methyl]pyrrolidin-3-yl]methanol
CID 72907482
1-cyclohexyloxy-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol;dihydrochloride
CID 44782587
2-[[4-(hydroxymethyl)piperidin-1-yl]methyl]cyclohexan-1-ol
CID 62610386

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol?
The IUPAC name of 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol (CID 62610058) is 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol?
The canonical SMILES for 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol is OC1CCCCC1CN1CCN(c2ccc(F)cc2)CC1.
What is the InChIKey of 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol?
The InChIKey is GTZACQFZTWIBRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O/c18-15-5-7-16(8-6-15)20-11-9-19(10-12-20)13-14-3-1-2-4-17(14)21/h5-8,14,17,21H,1-4,9-13H2.
What are the key properties of 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol?
2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol has a molecular weight of 292.40 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol is sourced from PubChem (CID 62610058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).