1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine

C17H25ClN2 — CID 23856792

IUPAC1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine
SMILESCC1CCC(N2CCN(c3ccc(Cl)cc3)CC2)CC1
InChIInChI=1S/C17H25ClN2/c1-14-2-6-16(7-3-14)19-10-12-20(13-11-19)17-8-4-15(18)5-9-17/h4-5,8-9,14,16H,2-3,6-7,10-13H2,1H3
InChIKeyOJBURJRELPTSAT-UHFFFAOYSA-N
MW292.85 g/mol
LogP4.04
Rot. Bonds2

About 1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine

1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine (PubChem CID 23856792) has the molecular formula C17H25ClN2 and a molecular weight of 292.85 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine
PubChem CID23856792
Molecular FormulaC17H25ClN2
Molecular Weight292.85 g/mol
Exact Mass292.17
IUPAC Name1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine
SMILESCC1CCC(N2CCN(c3ccc(Cl)cc3)CC2)CC1
InChIInChI=1S/C17H25ClN2/c1-14-2-6-16(7-3-14)19-10-12-20(13-11-19)17-8-4-15(18)5-9-17/h4-5,8-9,14,16H,2-3,6-7,10-13H2,1H3
InChIKeyOJBURJRELPTSAT-UHFFFAOYSA-N
XLogP4.04
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.85
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[4-(4-chlorophenyl)piperazin-1-yl]cyclohexan-1-ol
CID 114762371
1-(4-methylcyclohexyl)-4-(4-nitrophenyl)piperazine
CID 2846428
1-(3-methylcyclopentyl)-4-(4-methylphenyl)piperazine
CID 2845220
1-(4-chlorophenyl)-4-[(3R)-thiolan-3-yl]piperazine
CID 26458363
1-[(1S,3S)-3-methylcyclopentyl]-4-phenylpiperazine
CID 6937921
4-(4-cyclopropylpiperazin-1-yl)benzenethiol
CID 91011479
N-(4-iodobenzoyl)-4-[4-(4-methylcyclohexyl)piperazin-1-yl]benzohydrazide
CID 91471006
1-cyclohexyl-4-(4-methylphenyl)piperazine
CID 20655127
1-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-4-(4-fluorophenyl)piperazine
CID 4061277
(3R)-1-[1-(4-chlorophenyl)piperidin-4-yl]pyrrolidin-3-amine
CID 126445475
1-(4-tert-butylcyclohexyl)-4-(3-chlorophenyl)piperazine
CID 784467
1-(4-chlorophenyl)-4-methylpiperidin-4-ol;ethane
CID 155585717

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine?
The IUPAC name of 1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine (CID 23856792) is 1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine.
What is the SMILES notation for 1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine?
The canonical SMILES for 1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine is CC1CCC(N2CCN(c3ccc(Cl)cc3)CC2)CC1.
What is the InChIKey of 1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine?
The InChIKey is OJBURJRELPTSAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25ClN2/c1-14-2-6-16(7-3-14)19-10-12-20(13-11-19)17-8-4-15(18)5-9-17/h4-5,8-9,14,16H,2-3,6-7,10-13H2,1H3.
What are the key properties of 1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine?
1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine has a molecular weight of 292.85 g/mol, XLogP of 4.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-4-(4-methylcyclohexyl)piperazine is sourced from PubChem (CID 23856792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).