(3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone

C22H26N2O2 — CID 72918423

IUPAC(3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone
SMILESO=C([C@H]1C[C@H](O)CN1)N1CCCC(c2ccccc2)(c2ccccc2)C1
InChIInChI=1S/C22H26N2O2/c25-19-14-20(23-15-19)21(26)24-13-7-12-22(16-24,17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-6,8-11,19-20,23,25H,7,12-16H2/t19-,20+/m0/s1
InChIKeyQDTDXVOHROXHDV-VQTJNVASSA-N
MW350.46 g/mol
LogP2.32
Rot. Bonds3

About (3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone

(3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone (PubChem CID 72918423) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is (3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone.

Molecular Properties

Compound Name(3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone
PubChem CID72918423
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name(3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone
SMILESO=C([C@H]1C[C@H](O)CN1)N1CCCC(c2ccccc2)(c2ccccc2)C1
InChIInChI=1S/C22H26N2O2/c25-19-14-20(23-15-19)21(26)24-13-7-12-22(16-24,17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-6,8-11,19-20,23,25H,7,12-16H2/t19-,20+/m0/s1
InChIKeyQDTDXVOHROXHDV-VQTJNVASSA-N
XLogP2.32
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3,3-diphenylpiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone;hydrochloride
CID 154900279
(6S)-6-(3,3-diphenylpiperidine-1-carbonyl)piperazin-2-one
CID 97134489
2-azaspiro[5.5]undecan-2-yl-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone
CID 124703429
2-azaspiro[5.5]undecan-2-yl-[(2R,4R)-4-hydroxypyrrolidin-2-yl]methanone
CID 124701635
(3,3-dimethylpyrrolidin-1-yl)-(4-hydroxypyrrolidin-2-yl)methanone;hydrochloride
CID 119781993
(3-ethyl-3-methylpiperidin-1-yl)-(4-hydroxypyrrolidin-2-yl)methanone
CID 119789063
azepan-1-yl-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone
CID 28943560
(3,3-diphenylpiperidin-1-yl)-(oxan-2-yl)methanone
CID 118773107
(3,3-diphenylpiperidin-1-yl)-[(2S)-oxan-2-yl]methanone
CID 125170830
2-azaspiro[4.5]decan-2-yl-(4-hydroxypyrrolidin-2-yl)methanone
CID 119805335
(4-hydroxypyrrolidin-2-yl)-(3-methyl-3-propylpiperidin-1-yl)methanone
CID 119791971
1-[4-(4-hydroxypyrrolidine-2-carbonyl)-1,4-diazepan-1-yl]-3-phenylpropan-1-one
CID 119754752

Frequently Asked Questions

What is the IUPAC name of (3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone?
The IUPAC name of (3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone (CID 72918423) is (3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone.
What is the SMILES notation for (3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone?
The canonical SMILES for (3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone is O=C([C@H]1C[C@H](O)CN1)N1CCCC(c2ccccc2)(c2ccccc2)C1.
What is the InChIKey of (3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone?
The InChIKey is QDTDXVOHROXHDV-VQTJNVASSA-N. The full InChI is InChI=1S/C22H26N2O2/c25-19-14-20(23-15-19)21(26)24-13-7-12-22(16-24,17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-6,8-11,19-20,23,25H,7,12-16H2/t19-,20+/m0/s1.
What are the key properties of (3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone?
(3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone has a molecular weight of 350.46 g/mol, XLogP of 2.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-diphenylpiperidin-1-yl)-[(2R,4S)-4-hydroxypyrrolidin-2-yl]methanone is sourced from PubChem (CID 72918423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).