1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine

C22H34N2 — CID 1375643

IUPAC1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine
SMILESc1ccc(C2CCC(N3CCC(N4CCCCC4)CC3)CC2)cc1
InChIInChI=1S/C22H34N2/c1-3-7-19(8-4-1)20-9-11-21(12-10-20)24-17-13-22(14-18-24)23-15-5-2-6-16-23/h1,3-4,7-8,20-22H,2,5-6,9-18H2
InChIKeyRRYAWQLOSDUAMD-UHFFFAOYSA-N
MW326.53 g/mol
LogP4.66
Rot. Bonds3

About 1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine

1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine (PubChem CID 1375643) has the molecular formula C22H34N2 and a molecular weight of 326.53 g/mol. Its IUPAC name is 1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine.

Molecular Properties

Compound Name1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine
PubChem CID1375643
Molecular FormulaC22H34N2
Molecular Weight326.53 g/mol
Exact Mass326.27
IUPAC Name1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine
SMILESc1ccc(C2CCC(N3CCC(N4CCCCC4)CC3)CC2)cc1
InChIInChI=1S/C22H34N2/c1-3-7-19(8-4-1)20-9-11-21(12-10-20)24-17-13-22(14-18-24)23-15-5-2-6-16-23/h1,3-4,7-8,20-22H,2,5-6,9-18H2
InChIKeyRRYAWQLOSDUAMD-UHFFFAOYSA-N
XLogP4.66
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.53
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine?
The IUPAC name of 1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine (CID 1375643) is 1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine.
What is the SMILES notation for 1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine?
The canonical SMILES for 1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine is c1ccc(C2CCC(N3CCC(N4CCCCC4)CC3)CC2)cc1.
What is the InChIKey of 1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine?
The InChIKey is RRYAWQLOSDUAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2/c1-3-7-19(8-4-1)20-9-11-21(12-10-20)24-17-13-22(14-18-24)23-15-5-2-6-16-23/h1,3-4,7-8,20-22H,2,5-6,9-18H2.
What are the key properties of 1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine?
1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine has a molecular weight of 326.53 g/mol, XLogP of 4.66, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenylcyclohexyl)-4-piperidin-1-ylpiperidine is sourced from PubChem (CID 1375643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).