[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol

C26H29NO2 — CID 14851350

IUPAC[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol
SMILESCOc1cccc(CN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)c1
InChIInChI=1S/C26H29NO2/c1-29-25-14-8-9-21(19-25)20-27-17-15-24(16-18-27)26(28,22-10-4-2-5-11-22)23-12-6-3-7-13-23/h2-14,19,24,28H,15-18,20H2,1H3
InChIKeyWVRBGIPAOUQSBJ-UHFFFAOYSA-N
MW387.52 g/mol
LogP4.84
Rot. Bonds6

About [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol

[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol (PubChem CID 14851350) has the molecular formula C26H29NO2 and a molecular weight of 387.52 g/mol. Its IUPAC name is [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol.

Molecular Properties

Compound Name[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol
PubChem CID14851350
Molecular FormulaC26H29NO2
Molecular Weight387.52 g/mol
Exact Mass387.22
IUPAC Name[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol
SMILESCOc1cccc(CN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)c1
InChIInChI=1S/C26H29NO2/c1-29-25-14-8-9-21(19-25)20-27-17-15-24(16-18-27)26(28,22-10-4-2-5-11-22)23-12-6-3-7-13-23/h2-14,19,24,28H,15-18,20H2,1H3
InChIKeyWVRBGIPAOUQSBJ-UHFFFAOYSA-N
XLogP4.84
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.52
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol?
The IUPAC name of [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol (CID 14851350) is [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol.
What is the SMILES notation for [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol?
The canonical SMILES for [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol is COc1cccc(CN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)c1.
What is the InChIKey of [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol?
The InChIKey is WVRBGIPAOUQSBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29NO2/c1-29-25-14-8-9-21(19-25)20-27-17-15-24(16-18-27)26(28,22-10-4-2-5-11-22)23-12-6-3-7-13-23/h2-14,19,24,28H,15-18,20H2,1H3.
What are the key properties of [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol?
[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol has a molecular weight of 387.52 g/mol, XLogP of 4.84, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-diphenylmethanol is sourced from PubChem (CID 14851350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).