1-benzyl-4-phenylpyrrolidin-3-ol

C17H19NO — CID 12044053

IUPAC1-benzyl-4-phenylpyrrolidin-3-ol
SMILESOC1CN(Cc2ccccc2)CC1c1ccccc1
InChIInChI=1S/C17H19NO/c19-17-13-18(11-14-7-3-1-4-8-14)12-16(17)15-9-5-2-6-10-15/h1-10,16-17,19H,11-13H2
InChIKeyUIWLXOCYASIRRA-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.65
Rot. Bonds3

About 1-benzyl-4-phenylpyrrolidin-3-ol

1-benzyl-4-phenylpyrrolidin-3-ol (PubChem CID 12044053) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is 1-benzyl-4-phenylpyrrolidin-3-ol.

Molecular Properties

Compound Name1-benzyl-4-phenylpyrrolidin-3-ol
PubChem CID12044053
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name1-benzyl-4-phenylpyrrolidin-3-ol
SMILESOC1CN(Cc2ccccc2)CC1c1ccccc1
InChIInChI=1S/C17H19NO/c19-17-13-18(11-14-7-3-1-4-8-14)12-16(17)15-9-5-2-6-10-15/h1-10,16-17,19H,11-13H2
InChIKeyUIWLXOCYASIRRA-UHFFFAOYSA-N
XLogP2.65
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-3,4-diphenylpyrrolidine
CID 5136126
(3R,4R)-1-benzyl-4-phenylpiperidin-3-ol
CID 54282589
1-[4-[(3R,4S)-1-benzyl-4-hydroxypyrrolidin-3-yl]phenyl]ethanone
CID 134951863
1-benzylazepane-3,4,5,6-tetrol
CID 18417354
(3S,4R,5R,6S)-1-benzylazepane-3,4,5,6-tetrol
CID 10824756
1-benzyl-3-methyl-4-phenylpyrrolidine
CID 3522572
(4S)-1-benzyl-3-methyl-4-phenylpyrrolidine
CID 71104653
(3S,4R)-1-benzyl-4-phenylpyrrolidine-3-carboxylic acid
CID 12922299
(3S,4R)-1-benzyl-4-phenylpyrrolidine-3-carboxamide
CID 91662836
1,3-bis[(3R,4S)-1-benzyl-4-phenylpyrrolidin-3-yl]urea
CID 102127410
(3S,4R)-1-benzyl-N-methyl-4-phenylpyrrolidin-3-amine
CID 59840122
[(3R,4R)-1-benzyl-4-phenylpyrrolidin-3-yl]-phenylmethanone
CID 125474288

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-phenylpyrrolidin-3-ol?
The IUPAC name of 1-benzyl-4-phenylpyrrolidin-3-ol (CID 12044053) is 1-benzyl-4-phenylpyrrolidin-3-ol.
What is the SMILES notation for 1-benzyl-4-phenylpyrrolidin-3-ol?
The canonical SMILES for 1-benzyl-4-phenylpyrrolidin-3-ol is OC1CN(Cc2ccccc2)CC1c1ccccc1.
What is the InChIKey of 1-benzyl-4-phenylpyrrolidin-3-ol?
The InChIKey is UIWLXOCYASIRRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c19-17-13-18(11-14-7-3-1-4-8-14)12-16(17)15-9-5-2-6-10-15/h1-10,16-17,19H,11-13H2.
What are the key properties of 1-benzyl-4-phenylpyrrolidin-3-ol?
1-benzyl-4-phenylpyrrolidin-3-ol has a molecular weight of 253.35 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-phenylpyrrolidin-3-ol is sourced from PubChem (CID 12044053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).