2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol

C25H27NO3 — CID 3079041

IUPAC2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol
SMILESCOc1ccc(C2CC(O)C(c3ccccc3)C(c3ccc(OC)cc3)N2)cc1
InChIInChI=1S/C25H27NO3/c1-28-20-12-8-17(9-13-20)22-16-23(27)24(18-6-4-3-5-7-18)25(26-22)19-10-14-21(29-2)15-11-19/h3-15,22-27H,16H2,1-2H3
InChIKeyGEHHCFKXRWQVAP-UHFFFAOYSA-N
MW389.50 g/mol
LogP4.62
Rot. Bonds5

About 2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol

2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol (PubChem CID 3079041) has the molecular formula C25H27NO3 and a molecular weight of 389.50 g/mol. Its IUPAC name is 2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol.

Molecular Properties

Compound Name2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol
PubChem CID3079041
Molecular FormulaC25H27NO3
Molecular Weight389.50 g/mol
Exact Mass389.20
IUPAC Name2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol
SMILESCOc1ccc(C2CC(O)C(c3ccccc3)C(c3ccc(OC)cc3)N2)cc1
InChIInChI=1S/C25H27NO3/c1-28-20-12-8-17(9-13-20)22-16-23(27)24(18-6-4-3-5-7-18)25(26-22)19-10-14-21(29-2)15-11-19/h3-15,22-27H,16H2,1-2H3
InChIKeyGEHHCFKXRWQVAP-UHFFFAOYSA-N
XLogP4.62
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol?
The IUPAC name of 2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol (CID 3079041) is 2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol.
What is the SMILES notation for 2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol?
The canonical SMILES for 2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol is COc1ccc(C2CC(O)C(c3ccccc3)C(c3ccc(OC)cc3)N2)cc1.
What is the InChIKey of 2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol?
The InChIKey is GEHHCFKXRWQVAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27NO3/c1-28-20-12-8-17(9-13-20)22-16-23(27)24(18-6-4-3-5-7-18)25(26-22)19-10-14-21(29-2)15-11-19/h3-15,22-27H,16H2,1-2H3.
What are the key properties of 2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol?
2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol has a molecular weight of 389.50 g/mol, XLogP of 4.62, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(4-methoxyphenyl)-3-phenylpiperidin-4-ol is sourced from PubChem (CID 3079041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).