1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine

C27H37N3 — CID 1317152

IUPAC1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine
SMILESc1ccc(C2CCC(N3CCC(N4CCN(c5ccccc5)CC4)CC3)CC2)cc1
InChIInChI=1S/C27H37N3/c1-3-7-23(8-4-1)24-11-13-26(14-12-24)28-17-15-27(16-18-28)30-21-19-29(20-22-30)25-9-5-2-6-10-25/h1-10,24,26-27H,11-22H2
InChIKeyPSYGAJJEDFKFIE-UHFFFAOYSA-N
MW403.61 g/mol
LogP5.00
Rot. Bonds4

About 1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine

1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine (PubChem CID 1317152) has the molecular formula C27H37N3 and a molecular weight of 403.61 g/mol. Its IUPAC name is 1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine.

Molecular Properties

Compound Name1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine
PubChem CID1317152
Molecular FormulaC27H37N3
Molecular Weight403.61 g/mol
Exact Mass403.30
IUPAC Name1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine
SMILESc1ccc(C2CCC(N3CCC(N4CCN(c5ccccc5)CC4)CC3)CC2)cc1
InChIInChI=1S/C27H37N3/c1-3-7-23(8-4-1)24-11-13-26(14-12-24)28-17-15-27(16-18-28)30-21-19-29(20-22-30)25-9-5-2-6-10-25/h1-10,24,26-27H,11-22H2
InChIKeyPSYGAJJEDFKFIE-UHFFFAOYSA-N
XLogP5.00
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.61
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(4-phenylcyclohexyl)piperazin-1-yl]pyrimidine
CID 19958540
1-cycloheptyl-4-phenylpiperazine
CID 2846720
4-(azetidin-1-yl)-1-phenylpiperidine
CID 174605037
1-phenyl-4-[1-[(3S)-thiolan-3-yl]piperidin-4-yl]piperazine
CID 124841342
1-[1-[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]piperidin-4-yl]-4-phenylpiperazine
CID 11877899
1-(4-phenylcyclohexyl)piperazine chloride
CID 53347254
methyl 4-[[[4-[4-(4-phenylcyclohexyl)piperazin-1-yl]benzoyl]amino]carbamoyl]benzoate
CID 22492888
1-cyclodecyl-4-phenylpiperidine;hydrochloride
CID 70215634
1-[(1S,3S)-3-methylcyclopentyl]-4-phenylpiperazine
CID 6937921
4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine
CID 142115785
1-(1-phenylpiperidin-4-yl)piperazine
CID 2737157
4-phenyl-1-(4-pyrrolidin-1-ylphenyl)piperidine
CID 154349377

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine?
The IUPAC name of 1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine (CID 1317152) is 1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine.
What is the SMILES notation for 1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine?
The canonical SMILES for 1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine is c1ccc(C2CCC(N3CCC(N4CCN(c5ccccc5)CC4)CC3)CC2)cc1.
What is the InChIKey of 1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine?
The InChIKey is PSYGAJJEDFKFIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H37N3/c1-3-7-23(8-4-1)24-11-13-26(14-12-24)28-17-15-27(16-18-28)30-21-19-29(20-22-30)25-9-5-2-6-10-25/h1-10,24,26-27H,11-22H2.
What are the key properties of 1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine?
1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine has a molecular weight of 403.61 g/mol, XLogP of 5.00, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine is sourced from PubChem (CID 1317152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).