cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone

C17H24N2O2 — CID 78777393

IUPACcyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone
SMILESO=C(C1CCCCC1)N1CCN(c2ccc(O)cc2)CC1
InChIInChI=1S/C17H24N2O2/c20-16-8-6-15(7-9-16)18-10-12-19(13-11-18)17(21)14-4-2-1-3-5-14/h6-9,14,20H,1-5,10-13H2
InChIKeyHTVHZOSZGYCFSQ-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.62
Rot. Bonds2

About cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone

cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone (PubChem CID 78777393) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namecyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone
PubChem CID78777393
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Namecyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone
SMILESO=C(C1CCCCC1)N1CCN(c2ccc(O)cc2)CC1
InChIInChI=1S/C17H24N2O2/c20-16-8-6-15(7-9-16)18-10-12-19(13-11-18)17(21)14-4-2-1-3-5-14/h6-9,14,20H,1-5,10-13H2
InChIKeyHTVHZOSZGYCFSQ-UHFFFAOYSA-N
XLogP2.62
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclobutyl-[4-(4-piperidin-1-ylphenyl)piperazin-1-yl]methanone
CID 113079016
[4-(4-hydroxyphenyl)piperazin-1-yl]-(1-methylazepan-2-yl)methanone
CID 131927700
cyclohexyl-[4-[4-(dimethylamino)phenyl]piperazin-1-yl]methanone
CID 113078713
N-[4-[4-(cyclohexanecarbonyl)piperazin-1-yl]phenyl]cyclobutanecarboxamide
CID 1055992
4-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]benzamide
CID 68550560
cyclobutyl-[4-[4-(4-methylpiperidin-1-yl)phenyl]piperazin-1-yl]methanone
CID 113079073
[4-(4-hydroxyphenyl)piperazin-1-yl]-piperidin-2-ylmethanone
CID 60936747
5-[4-(cyclohexanecarbonyl)piperazin-1-yl]-1H-pyridin-2-one
CID 110735913
N-cyclohexyl-4-(4-hydroxyphenyl)piperazine-1-carboxamide
CID 4169539
aziridin-1-yl(cyclohexyl)methanone
CID 2309619
[4-(4-hydroxyphenyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 47098482
[4-(3-chlorophenyl)piperazin-1-yl]-cyclohexylmethanone
CID 798144

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone?
The IUPAC name of cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone (CID 78777393) is cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone.
What is the SMILES notation for cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone?
The canonical SMILES for cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone is O=C(C1CCCCC1)N1CCN(c2ccc(O)cc2)CC1.
What is the InChIKey of cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone?
The InChIKey is HTVHZOSZGYCFSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c20-16-8-6-15(7-9-16)18-10-12-19(13-11-18)17(21)14-4-2-1-3-5-14/h6-9,14,20H,1-5,10-13H2.
What are the key properties of cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone?
cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone has a molecular weight of 288.39 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone is sourced from PubChem (CID 78777393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).