2,2,3-triphenylcyclopentan-1-one

C23H20O — CID 90111687

IUPAC2,2,3-triphenylcyclopentan-1-one
SMILESO=C1CCC(c2ccccc2)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H20O/c24-22-17-16-21(18-10-4-1-5-11-18)23(22,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21H,16-17H2
InChIKeyMUPQNNSDHVZHNQ-UHFFFAOYSA-N
MW312.41 g/mol
LogP5.12
Rot. Bonds3

About 2,2,3-triphenylcyclopentan-1-one

2,2,3-triphenylcyclopentan-1-one (PubChem CID 90111687) has the molecular formula C23H20O and a molecular weight of 312.41 g/mol. Its IUPAC name is 2,2,3-triphenylcyclopentan-1-one.

Molecular Properties

Compound Name2,2,3-triphenylcyclopentan-1-one
PubChem CID90111687
Molecular FormulaC23H20O
Molecular Weight312.41 g/mol
Exact Mass312.15
IUPAC Name2,2,3-triphenylcyclopentan-1-one
SMILESO=C1CCC(c2ccccc2)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H20O/c24-22-17-16-21(18-10-4-1-5-11-18)23(22,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21H,16-17H2
InChIKeyMUPQNNSDHVZHNQ-UHFFFAOYSA-N
XLogP5.12
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.41
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-phenylspiro[2.4]heptane-4,7-dione
CID 132603438
cis-(2S,3S)-3-hydroxy-2-methyl-2-phenylcyclopentan-1-one
CID 131179314
3-(1,3-dioxo-2-phenylinden-2-yl)piperidine-2,6-dione
CID 3059034
(6S,11S)-11-phenylspiro[5.5]undecan-5-one
CID 102210888
(1,2,2-trimethyl-3-phenylcyclobutyl)benzene
CID 175871621
trans-(4R,5R)-4,5-diphenylcycloheptan-1-one
CID 58293688
2-phenylspiro[2.5]octan-8-one
CID 14952236
(1,2,3,5-tetraphenylcyclopent-2-en-1-yl)benzene
CID 102351980
3'-phenylspiro[4H-naphthalene-2,2'-cyclobutane]-1,1',3-trione
CID 101184968
2-methyl-3-phenylcyclopentan-1-one
CID 12573116
(3R)-3-phenylcyclohexan-1-one
CID 11041212
cis-(1R,2R)-1,2-diphenylcyclopropan-1-ol
CID 165358316

Frequently Asked Questions

What is the IUPAC name of 2,2,3-triphenylcyclopentan-1-one?
The IUPAC name of 2,2,3-triphenylcyclopentan-1-one (CID 90111687) is 2,2,3-triphenylcyclopentan-1-one.
What is the SMILES notation for 2,2,3-triphenylcyclopentan-1-one?
The canonical SMILES for 2,2,3-triphenylcyclopentan-1-one is O=C1CCC(c2ccccc2)C1(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2,3-triphenylcyclopentan-1-one?
The InChIKey is MUPQNNSDHVZHNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20O/c24-22-17-16-21(18-10-4-1-5-11-18)23(22,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21H,16-17H2.
What are the key properties of 2,2,3-triphenylcyclopentan-1-one?
2,2,3-triphenylcyclopentan-1-one has a molecular weight of 312.41 g/mol, XLogP of 5.12, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3-triphenylcyclopentan-1-one is sourced from PubChem (CID 90111687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).