1-[4-(2-methylphenyl)cyclohexyl]piperazine

C17H26N2 — CID 82300745

IUPAC1-[4-(2-methylphenyl)cyclohexyl]piperazine
SMILESCc1ccccc1C1CCC(N2CCNCC2)CC1
InChIInChI=1S/C17H26N2/c1-14-4-2-3-5-17(14)15-6-8-16(9-7-15)19-12-10-18-11-13-19/h2-5,15-16,18H,6-13H2,1H3
InChIKeyGEOHPABQODFSFS-UHFFFAOYSA-N
MW258.41 g/mol
LogP2.93
Rot. Bonds2

About 1-[4-(2-methylphenyl)cyclohexyl]piperazine

1-[4-(2-methylphenyl)cyclohexyl]piperazine (PubChem CID 82300745) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 1-[4-(2-methylphenyl)cyclohexyl]piperazine.

Molecular Properties

Compound Name1-[4-(2-methylphenyl)cyclohexyl]piperazine
PubChem CID82300745
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name1-[4-(2-methylphenyl)cyclohexyl]piperazine
SMILESCc1ccccc1C1CCC(N2CCNCC2)CC1
InChIInChI=1S/C17H26N2/c1-14-4-2-3-5-17(14)15-6-8-16(9-7-15)19-12-10-18-11-13-19/h2-5,15-16,18H,6-13H2,1H3
InChIKeyGEOHPABQODFSFS-UHFFFAOYSA-N
XLogP2.93
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[4-(2-methylphenyl)cyclohexyl]piperazine 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

1-(4-phenylcyclohexyl)piperazine chloride
CID 53347254
1-[(1S,5S)-3-bicyclo[3.2.1]octanyl]-4-(2-methylphenyl)piperidine
CID 124635425
1-[(1S,3R)-3-(2-methylphenyl)cyclopentyl]pyrrole
CID 141383259
1-(1-phenylpiperidin-4-yl)piperazine
CID 2737157
1-[1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)azetidin-3-yl]piperazine
CID 115419464
ethane;3-(2-methylphenyl)piperidine
CID 144655647
2-(4-piperazin-1-ylcyclohexyl)-6-sulfinamoylbenzenecarboximidamide
CID 144893781
1-(2,3-dihydro-1H-inden-2-yl)piperazine
CID 22648168
1-[4-(bromomethyl)cyclohexyl]-2-methylbenzene
CID 126696164
(5-cyclopropyl-1-piperidin-4-ylpyrazol-4-yl)-[(3S)-3-(2-methylphenyl)pyrrolidin-1-yl]methanone
CID 58324687
1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride
CID 50944348
1-cyclopentylpiperazine;ethane
CID 143559542

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methylphenyl)cyclohexyl]piperazine?
The IUPAC name of 1-[4-(2-methylphenyl)cyclohexyl]piperazine (CID 82300745) is 1-[4-(2-methylphenyl)cyclohexyl]piperazine.
What is the SMILES notation for 1-[4-(2-methylphenyl)cyclohexyl]piperazine?
The canonical SMILES for 1-[4-(2-methylphenyl)cyclohexyl]piperazine is Cc1ccccc1C1CCC(N2CCNCC2)CC1.
What is the InChIKey of 1-[4-(2-methylphenyl)cyclohexyl]piperazine?
The InChIKey is GEOHPABQODFSFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-14-4-2-3-5-17(14)15-6-8-16(9-7-15)19-12-10-18-11-13-19/h2-5,15-16,18H,6-13H2,1H3.
What are the key properties of 1-[4-(2-methylphenyl)cyclohexyl]piperazine?
1-[4-(2-methylphenyl)cyclohexyl]piperazine has a molecular weight of 258.41 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methylphenyl)cyclohexyl]piperazine is sourced from PubChem (CID 82300745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).