2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone

C24H23NO — CID 2910235

IUPAC2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone
SMILESO=C(C(c1ccccc1)c1ccccc1)N1CCC(c2ccccc2)C1
InChIInChI=1S/C24H23NO/c26-24(25-17-16-22(18-25)19-10-4-1-5-11-19)23(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22-23H,16-18H2
InChIKeyMMINBKMQQKYAAE-UHFFFAOYSA-N
MW341.45 g/mol
LogP4.83
Rot. Bonds4

About 2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone

2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone (PubChem CID 2910235) has the molecular formula C24H23NO and a molecular weight of 341.45 g/mol. Its IUPAC name is 2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone.

Molecular Properties

Compound Name2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone
PubChem CID2910235
Molecular FormulaC24H23NO
Molecular Weight341.45 g/mol
Exact Mass341.18
IUPAC Name2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone
SMILESO=C(C(c1ccccc1)c1ccccc1)N1CCC(c2ccccc2)C1
InChIInChI=1S/C24H23NO/c26-24(25-17-16-22(18-25)19-10-4-1-5-11-19)23(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22-23H,16-18H2
InChIKeyMMINBKMQQKYAAE-UHFFFAOYSA-N
XLogP4.83
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.45
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-amino-2-phenyl-1-(3-phenylpyrrolidin-1-yl)ethanone;hydrochloride
CID 119290269
2-bromo-1-(3-phenylpyrrolidin-1-yl)propan-1-one
CID 107905122
1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone
CID 110868603
2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone
CID 119278410
1-[(3S)-3-methylpiperidin-1-yl]-2,2-diphenylethanone
CID 1292213
2-methoxy-1-(3-phenylpyrrolidin-1-yl)propan-1-one
CID 112687859
(2S)-2-amino-1-(3-phenylpyrrolidin-1-yl)butan-1-one
CID 79023414
1-[3-(1H-indol-3-yl)pyrrolidin-1-yl]-2,2-diphenylethanone
CID 113087750
phenyl-(3-phenylpyrrolidin-1-yl)methanone
CID 6422044
2,2-diphenyl-1-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]ethanone
CID 113002906
1-[4-(2,2-diphenylacetyl)-1,4-diazepan-1-yl]-2,2-diphenylethanone
CID 5069183
2-methyl-1-(3-phenylazepan-1-yl)propan-1-one
CID 90608399

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone?
The IUPAC name of 2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone (CID 2910235) is 2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone.
What is the SMILES notation for 2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone?
The canonical SMILES for 2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone is O=C(C(c1ccccc1)c1ccccc1)N1CCC(c2ccccc2)C1.
What is the InChIKey of 2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone?
The InChIKey is MMINBKMQQKYAAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO/c26-24(25-17-16-22(18-25)19-10-4-1-5-11-19)23(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22-23H,16-18H2.
What are the key properties of 2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone?
2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone has a molecular weight of 341.45 g/mol, XLogP of 4.83, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone is sourced from PubChem (CID 2910235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).