(3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol

C24H25NO2 — CID 11279846

IUPAC(3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol
SMILESO[C@@H]1C[C@H](C(O)(c2ccccc2)c2ccccc2)N(Cc2ccccc2)C1
InChIInChI=1S/C24H25NO2/c26-22-16-23(25(18-22)17-19-10-4-1-5-11-19)24(27,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22-23,26-27H,16-18H2/t22-,23-/m1/s1
InChIKeyQYSMEBGSHQLGQL-DHIUTWEWSA-N
MW359.47 g/mol
LogP3.56
Rot. Bonds5

About (3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol

(3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol (PubChem CID 11279846) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is (3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol.

Molecular Properties

Compound Name(3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol
PubChem CID11279846
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC Name(3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol
SMILESO[C@@H]1C[C@H](C(O)(c2ccccc2)c2ccccc2)N(Cc2ccccc2)C1
InChIInChI=1S/C24H25NO2/c26-22-16-23(25(18-22)17-19-10-4-1-5-11-19)24(27,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22-23,26-27H,16-18H2/t22-,23-/m1/s1
InChIKeyQYSMEBGSHQLGQL-DHIUTWEWSA-N
XLogP3.56
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol?
The IUPAC name of (3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol (CID 11279846) is (3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol.
What is the SMILES notation for (3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol?
The canonical SMILES for (3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol is O[C@@H]1C[C@H](C(O)(c2ccccc2)c2ccccc2)N(Cc2ccccc2)C1.
What is the InChIKey of (3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol?
The InChIKey is QYSMEBGSHQLGQL-DHIUTWEWSA-N. The full InChI is InChI=1S/C24H25NO2/c26-22-16-23(25(18-22)17-19-10-4-1-5-11-19)24(27,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22-23,26-27H,16-18H2/t22-,23-/m1/s1.
What are the key properties of (3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol?
(3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol has a molecular weight of 359.47 g/mol, XLogP of 3.56, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5R)-1-benzyl-5-[hydroxy(diphenyl)methyl]pyrrolidin-3-ol is sourced from PubChem (CID 11279846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).