2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one

C19H20O — CID 116517019

IUPAC2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one
SMILESCC(C)(C(=O)C1CC1c1ccccc1)c1ccccc1
InChIInChI=1S/C19H20O/c1-19(2,15-11-7-4-8-12-15)18(20)17-13-16(17)14-9-5-3-6-10-14/h3-12,16-17H,13H2,1-2H3
InChIKeyVFZWICPRPPTYIC-UHFFFAOYSA-N
MW264.37 g/mol
LogP4.34
Rot. Bonds4

About 2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one

2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one (PubChem CID 116517019) has the molecular formula C19H20O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one.

Molecular Properties

Compound Name2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one
PubChem CID116517019
Molecular FormulaC19H20O
Molecular Weight264.37 g/mol
Exact Mass264.15
IUPAC Name2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one
SMILESCC(C)(C(=O)C1CC1c1ccccc1)c1ccccc1
InChIInChI=1S/C19H20O/c1-19(2,15-11-7-4-8-12-15)18(20)17-13-16(17)14-9-5-3-6-10-14/h3-12,16-17H,13H2,1-2H3
InChIKeyVFZWICPRPPTYIC-UHFFFAOYSA-N
XLogP4.34
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-dimethyl-1-(2-phenylcyclopropyl)propan-1-one
CID 76612897
2,2,2-trifluoro-1-[(1R,2R)-2-phenylcyclopropyl]ethanone
CID 45081115
ethane;2-phenylcyclopropane-1-carboxylic acid
CID 91570346
cis-(1R,2S)-2-phenylcyclopropane-1-carboxylic acid
CID 778516
trans-methyl (1S,2S)-2-phenylcyclopropane-1-carboxylate
CID 642984
2-methyl-1-(2-phenylcyclopropyl)-2-piperidin-3-ylpropan-1-one
CID 116611097
2-(tert-butylamino)-1-(2-phenylcyclopropyl)ethanone
CID 116588801
2-[(2-methylpropan-2-yl)oxy]-1-(2-phenylcyclopropyl)ethanone
CID 105134784
2-ethyl-1-(2-phenylcyclopropyl)-2-pyrrolidin-1-ylbutan-1-one
CID 116517097
2,2,3-trimethyl-3-[[(1S,2R)-2-phenylcyclopropanecarbonyl]amino]butanoic acid
CID 97234095
N-(2-hydroxy-2-methylpropyl)-2-phenylcyclopropane-1-carboxamide
CID 79039782
2-chloro-1-[(1S,2R)-2-phenylcyclopropyl]ethanone
CID 164769669

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one?
The IUPAC name of 2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one (CID 116517019) is 2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one.
What is the SMILES notation for 2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one?
The canonical SMILES for 2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one is CC(C)(C(=O)C1CC1c1ccccc1)c1ccccc1.
What is the InChIKey of 2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one?
The InChIKey is VFZWICPRPPTYIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O/c1-19(2,15-11-7-4-8-12-15)18(20)17-13-16(17)14-9-5-3-6-10-14/h3-12,16-17H,13H2,1-2H3.
What are the key properties of 2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one?
2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one has a molecular weight of 264.37 g/mol, XLogP of 4.34, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one is sourced from PubChem (CID 116517019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).