1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine

C19H30N2 — CID 167218455

IUPAC1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine
SMILESCC1CN(c2ccccc2)CCN1CCC1CCCCC1
InChIInChI=1S/C19H30N2/c1-17-16-21(19-10-6-3-7-11-19)15-14-20(17)13-12-18-8-4-2-5-9-18/h3,6-7,10-11,17-18H,2,4-5,8-9,12-16H2,1H3
InChIKeyNVDQKQSUEXGAMI-UHFFFAOYSA-N
MW286.46 g/mol
LogP4.17
Rot. Bonds4

About 1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine

1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine (PubChem CID 167218455) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine.

Molecular Properties

Compound Name1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine
PubChem CID167218455
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC Name1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine
SMILESCC1CN(c2ccccc2)CCN1CCC1CCCCC1
InChIInChI=1S/C19H30N2/c1-17-16-21(19-10-6-3-7-11-19)15-14-20(17)13-12-18-8-4-2-5-9-18/h3,6-7,10-11,17-18H,2,4-5,8-9,12-16H2,1H3
InChIKeyNVDQKQSUEXGAMI-UHFFFAOYSA-N
XLogP4.17
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-fluoroethyl)-2-methyl-4-phenylpiperazine
CID 150779486
(2S)-1-[2-(benzenesulfonyl)ethyl]-2-methyl-4-phenylpiperazine
CID 97254316
(2R)-1-[2-(benzenesulfonyl)ethyl]-2-methyl-4-phenylpiperazine
CID 97254315
4-[2-(4-phenylpiperazin-1-yl)ethyl]cyclohexan-1-amine
CID 10684726
ethane;1-phenyl-3-propylpiperidine
CID 123157098
1-(2-cyclohexylethyl)-4-(3-methylphenyl)piperazine
CID 173113720
1-[2-[2-methyl-4-(4-methylphenyl)piperazin-1-yl]ethyl]azepane;bis(2,2,2-trifluoroacetic acid)
CID 154889136
4-(2-cyclohexylethyl)-1-(2,3-dimethylphenyl)-5,6-dimethyl-1,4-diazepane
CID 142995321
(2R)-2-methyl-4-phenyl-1-[(1-propylimidazol-2-yl)methyl]piperazine
CID 124752379
methylcyclohexane;1-phenylpiperidine
CID 174582589
1-cycloheptyl-4-phenylpiperazine
CID 2846720
3-[2-[2-methyl-4-(2-methylphenyl)piperazin-1-yl]ethyl]thiolane 1,1-dioxide;bis(2,2,2-trifluoroacetic acid)
CID 154887770

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine?
The IUPAC name of 1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine (CID 167218455) is 1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine.
What is the SMILES notation for 1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine?
The canonical SMILES for 1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine is CC1CN(c2ccccc2)CCN1CCC1CCCCC1.
What is the InChIKey of 1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine?
The InChIKey is NVDQKQSUEXGAMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-17-16-21(19-10-6-3-7-11-19)15-14-20(17)13-12-18-8-4-2-5-9-18/h3,6-7,10-11,17-18H,2,4-5,8-9,12-16H2,1H3.
What are the key properties of 1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine?
1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine has a molecular weight of 286.46 g/mol, XLogP of 4.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylethyl)-2-methyl-4-phenylpiperazine is sourced from PubChem (CID 167218455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).