1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol

C25H27NO2 — CID 10109899

IUPAC1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol
SMILESCOc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1
InChIInChI=1S/C25H27NO2/c1-28-23-15-9-8-14-22(23)24(20-10-4-2-5-11-20)26-18-16-25(27,17-19-26)21-12-6-3-7-13-21/h2-15,24,27H,16-19H2,1H3
InChIKeyDFUCPZAAMSSVDD-UHFFFAOYSA-N
MW373.50 g/mol
LogP4.77
Rot. Bonds5

About 1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol

1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol (PubChem CID 10109899) has the molecular formula C25H27NO2 and a molecular weight of 373.50 g/mol. Its IUPAC name is 1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol.

Molecular Properties

Compound Name1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol
PubChem CID10109899
Molecular FormulaC25H27NO2
Molecular Weight373.50 g/mol
Exact Mass373.20
IUPAC Name1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol
SMILESCOc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1
InChIInChI=1S/C25H27NO2/c1-28-23-15-9-8-14-22(23)24(20-10-4-2-5-11-20)26-18-16-25(27,17-19-26)21-12-6-3-7-13-21/h2-15,24,27H,16-19H2,1H3
InChIKeyDFUCPZAAMSSVDD-UHFFFAOYSA-N
XLogP4.77
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol?
The IUPAC name of 1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol (CID 10109899) is 1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol.
What is the SMILES notation for 1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol?
The canonical SMILES for 1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol is COc1ccccc1C(c1ccccc1)N1CCC(O)(c2ccccc2)CC1.
What is the InChIKey of 1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol?
The InChIKey is DFUCPZAAMSSVDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27NO2/c1-28-23-15-9-8-14-22(23)24(20-10-4-2-5-11-20)26-18-16-25(27,17-19-26)21-12-6-3-7-13-21/h2-15,24,27H,16-19H2,1H3.
What are the key properties of 1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol?
1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol has a molecular weight of 373.50 g/mol, XLogP of 4.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methoxyphenyl)-phenylmethyl]-4-phenylpiperidin-4-ol is sourced from PubChem (CID 10109899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).