1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol

C26H29NO2 — CID 11560902

IUPAC1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol
SMILESCOc1cccc(C2(O)CCCN(CC(c3ccccc3)c3ccccc3)C2)c1
InChIInChI=1S/C26H29NO2/c1-29-24-15-8-14-23(18-24)26(28)16-9-17-27(20-26)19-25(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-8,10-15,18,25,28H,9,16-17,19-20H2,1H3
InChIKeyDEZVGFZKXKDWMP-UHFFFAOYSA-N
MW387.52 g/mol
LogP4.81
Rot. Bonds6

About 1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol

1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol (PubChem CID 11560902) has the molecular formula C26H29NO2 and a molecular weight of 387.52 g/mol. Its IUPAC name is 1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol.

Molecular Properties

Compound Name1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol
PubChem CID11560902
Molecular FormulaC26H29NO2
Molecular Weight387.52 g/mol
Exact Mass387.22
IUPAC Name1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol
SMILESCOc1cccc(C2(O)CCCN(CC(c3ccccc3)c3ccccc3)C2)c1
InChIInChI=1S/C26H29NO2/c1-29-24-15-8-14-23(18-24)26(28)16-9-17-27(20-26)19-25(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-8,10-15,18,25,28H,9,16-17,19-20H2,1H3
InChIKeyDEZVGFZKXKDWMP-UHFFFAOYSA-N
XLogP4.81
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 ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-hydroxy-3-(3-methoxyphenyl)piperidin-1-yl]-2,2-diphenylethanone
CID 11632745
1-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)piperidin-3-ol;hydrochloride
CID 11631684
1-[(4-bromophenyl)methyl]-3-(3-methoxyphenyl)piperidin-3-ol;hydrochloride
CID 11711307
3-(3-methoxyphenyl)-1-[(5-methyl-1H-indol-3-yl)methyl]piperidin-3-ol
CID 91156516
(3R)-1-benzyl-3-(4-methoxyphenyl)piperidin-3-ol
CID 92976626
(3R,9aR)-3-(3-methoxyphenyl)-1,2,4,6,7,8,9,9a-octahydroquinolizin-3-ol
CID 3044358
3-(3-aminophenyl)-1-ethylpiperidin-3-ol
CID 25223580
3-phenyl-1-(1-phenylpropyl)piperidin-3-ol
CID 18621526
N-[1-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-4-phenylpiperidin-4-yl]acetamide
CID 110221442
2-(azepan-1-ylmethyl)-1-(3-methoxyphenyl)cycloheptan-1-ol
CID 68801883
2-[4-hydroxy-4-(3-methoxyphenyl)piperidin-1-yl]-1-pyrrolidin-1-ylethanone
CID 1446395
6-(3-methoxyphenyl)-1-methyl-1-azaspiro[4.5]decan-6-ol
CID 141465392

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol?
The IUPAC name of 1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol (CID 11560902) is 1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol.
What is the SMILES notation for 1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol?
The canonical SMILES for 1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol is COc1cccc(C2(O)CCCN(CC(c3ccccc3)c3ccccc3)C2)c1.
What is the InChIKey of 1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol?
The InChIKey is DEZVGFZKXKDWMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29NO2/c1-29-24-15-8-14-23(18-24)26(28)16-9-17-27(20-26)19-25(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-8,10-15,18,25,28H,9,16-17,19-20H2,1H3.
What are the key properties of 1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol?
1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol has a molecular weight of 387.52 g/mol, XLogP of 4.81, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol is sourced from PubChem (CID 11560902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).