(3R,4R)-1-benzyl-4-phenylpiperidin-3-ol

C18H21NO — CID 54282589

IUPAC(3R,4R)-1-benzyl-4-phenylpiperidin-3-ol
SMILESO[C@H]1CN(Cc2ccccc2)CC[C@@H]1c1ccccc1
InChIInChI=1S/C18H21NO/c20-18-14-19(13-15-7-3-1-4-8-15)12-11-17(18)16-9-5-2-6-10-16/h1-10,17-18,20H,11-14H2/t17-,18+/m1/s1
InChIKeyRRVCCPCWJKCTCG-MSOLQXFVSA-N
MW267.37 g/mol
LogP3.04
Rot. Bonds3

About (3R,4R)-1-benzyl-4-phenylpiperidin-3-ol

(3R,4R)-1-benzyl-4-phenylpiperidin-3-ol (PubChem CID 54282589) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is (3R,4R)-1-benzyl-4-phenylpiperidin-3-ol.

Molecular Properties

Compound Name(3R,4R)-1-benzyl-4-phenylpiperidin-3-ol
PubChem CID54282589
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name(3R,4R)-1-benzyl-4-phenylpiperidin-3-ol
SMILESO[C@H]1CN(Cc2ccccc2)CC[C@@H]1c1ccccc1
InChIInChI=1S/C18H21NO/c20-18-14-19(13-15-7-3-1-4-8-15)12-11-17(18)16-9-5-2-6-10-16/h1-10,17-18,20H,11-14H2/t17-,18+/m1/s1
InChIKeyRRVCCPCWJKCTCG-MSOLQXFVSA-N
XLogP3.04
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R,4R)-1-benzyl-4-(4-methoxyphenyl)piperidin-3-ol
CID 118207526
1-benzyl-4-phenylpyrrolidin-3-ol
CID 12044053
(3R,4R)-1-benzyl-4-(3-phenylmethoxyphenyl)piperidin-3-ol
CID 131850383
1-benzyl-3-phenylpiperidine-4-carboxylic acid
CID 3345807
(3S,4R)-1-[(5-chloro-2-pyridinyl)methyl]-4-phenylpiperidin-3-ol
CID 162634174
(3S,4R)-1-[[3-(difluoromethoxy)phenyl]methyl]-4-phenylpiperidin-3-ol
CID 162633867
(3S,4R)-4-amino-1-benzylpiperidin-3-ol;hydrochloride
CID 67227523
(3R,4S)-1-benzyl-4-(hydroxymethyl)piperidin-3-ol
CID 15450831
(3R,4R)-4-amino-1-benzylpiperidin-3-ol;dihydrochloride
CID 163338239
1-benzyl-3,4-diphenylpyrrolidine
CID 5136126
1-benzyl-4-(3-hydroxyphenyl)piperidin-3-ol;1-benzyl-4-(3-methoxyphenyl)piperidin-3-ol
CID 161060195
1-benzyl-4-(iodomethyl)piperidin-3-ol
CID 71649873

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-1-benzyl-4-phenylpiperidin-3-ol?
The IUPAC name of (3R,4R)-1-benzyl-4-phenylpiperidin-3-ol (CID 54282589) is (3R,4R)-1-benzyl-4-phenylpiperidin-3-ol.
What is the SMILES notation for (3R,4R)-1-benzyl-4-phenylpiperidin-3-ol?
The canonical SMILES for (3R,4R)-1-benzyl-4-phenylpiperidin-3-ol is O[C@H]1CN(Cc2ccccc2)CC[C@@H]1c1ccccc1.
What is the InChIKey of (3R,4R)-1-benzyl-4-phenylpiperidin-3-ol?
The InChIKey is RRVCCPCWJKCTCG-MSOLQXFVSA-N. The full InChI is InChI=1S/C18H21NO/c20-18-14-19(13-15-7-3-1-4-8-15)12-11-17(18)16-9-5-2-6-10-16/h1-10,17-18,20H,11-14H2/t17-,18+/m1/s1.
What are the key properties of (3R,4R)-1-benzyl-4-phenylpiperidin-3-ol?
(3R,4R)-1-benzyl-4-phenylpiperidin-3-ol has a molecular weight of 267.37 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-1-benzyl-4-phenylpiperidin-3-ol is sourced from PubChem (CID 54282589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).