4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one

C17H24N2O2 — CID 10565307

IUPAC4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one
SMILESCOc1ccccc1N1CCN(C2CCC(=O)CC2)CC1
InChIInChI=1S/C17H24N2O2/c1-21-17-5-3-2-4-16(17)19-12-10-18(11-13-19)14-6-8-15(20)9-7-14/h2-5,14H,6-13H2,1H3
InChIKeyBKUIMWPAQDTYGH-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.33
Rot. Bonds3

About 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one

4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one (PubChem CID 10565307) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one.

Molecular Properties

Compound Name4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one
PubChem CID10565307
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one
SMILESCOc1ccccc1N1CCN(C2CCC(=O)CC2)CC1
InChIInChI=1S/C17H24N2O2/c1-21-17-5-3-2-4-16(17)19-12-10-18(11-13-19)14-6-8-15(20)9-7-14/h2-5,14H,6-13H2,1H3
InChIKeyBKUIMWPAQDTYGH-UHFFFAOYSA-N
XLogP2.33
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one 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

3-[4-(2-methoxyphenyl)piperazin-1-yl]cyclopentan-1-one
CID 112723099
1-(2-methoxyphenyl)-4-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine
CID 7441356
4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-amine
CID 10708578
1-(2-methoxyphenyl)-4-[(1S,3R)-3-methylcyclopentyl]piperazine
CID 782078
2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one
CID 15665473
1-[(3R)-1-cyclobutylpiperidin-3-yl]-4-(2-methoxyphenyl)piperazine
CID 92709243
4-[4-(2-methoxyphenyl)piperazin-1-yl]azepane
CID 103983150
1-[1-(2-methoxyethyl)piperidin-4-yl]-4-(2-methoxyphenyl)piperazine
CID 91811532
4-(4-naphthalen-1-ylpiperazin-1-yl)cyclohexan-1-one
CID 11098892
1-[1-(1-benzylpiperidin-4-yl)piperidin-4-yl]-4-(2-methoxyphenyl)piperazine
CID 5115878
1-(2-methoxyphenyl)-4-[(3R)-1-(1-methylpiperidin-4-yl)piperidin-3-yl]piperazine
CID 28786689
1-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-4-(2-methoxyphenyl)piperazine
CID 1332232

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one?
The IUPAC name of 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one (CID 10565307) is 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one.
What is the SMILES notation for 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one?
The canonical SMILES for 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one is COc1ccccc1N1CCN(C2CCC(=O)CC2)CC1.
What is the InChIKey of 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one?
The InChIKey is BKUIMWPAQDTYGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-21-17-5-3-2-4-16(17)19-12-10-18(11-13-19)14-6-8-15(20)9-7-14/h2-5,14H,6-13H2,1H3.
What are the key properties of 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one?
4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one has a molecular weight of 288.39 g/mol, XLogP of 2.33, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one is sourced from PubChem (CID 10565307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).