2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol

C19H22O — CID 116518430

IUPAC2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol
SMILESCCC(CO)(c1ccccc1)C1CC1c1ccccc1
InChIInChI=1S/C19H22O/c1-2-19(14-20,16-11-7-4-8-12-16)18-13-17(18)15-9-5-3-6-10-15/h3-12,17-18,20H,2,13-14H2,1H3
InChIKeyOSXUGSYMUXDIPS-UHFFFAOYSA-N
MW266.38 g/mol
LogP4.13
Rot. Bonds5

About 2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol

2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol (PubChem CID 116518430) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol.

Molecular Properties

Compound Name2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol
PubChem CID116518430
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol
SMILESCCC(CO)(c1ccccc1)C1CC1c1ccccc1
InChIInChI=1S/C19H22O/c1-2-19(14-20,16-11-7-4-8-12-16)18-13-17(18)15-9-5-3-6-10-15/h3-12,17-18,20H,2,13-14H2,1H3
InChIKeyOSXUGSYMUXDIPS-UHFFFAOYSA-N
XLogP4.13
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-bicyclo[2.2.1]heptanyl)-2-phenylbutan-1-ol
CID 114246918
2-[(1S,2S)-2-phenylcyclopropyl]propan-2-ol
CID 102315759
[(1S)-2-tert-butylcyclopropyl]benzene
CID 59541250
N-ethyl-2-methyl-2-(2-phenylcyclopropyl)butan-1-amine
CID 116518083
1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol
CID 116516707
2-ethyl-2-(2-phenylcyclopropyl)hexanoic acid
CID 116516649
2,2-dimethyl-3-[(2-phenylcyclopropyl)amino]propan-1-ol
CID 81411044
2-methyl-2-phenyl-1-(2-phenylcyclopropyl)propan-1-one
CID 116517019
3-[[(2-phenylcyclopropyl)amino]methyl]pentan-3-ol
CID 115919440
2-[(3,5-dimethylcyclohexyl)amino]-2-phenylpropan-1-ol
CID 115907198
diphenyl-[(1S,2S)-2-pyridin-4-ylcyclopropyl]methanol
CID 92533340
(2S)-2,5-dimethyl-3-phenyloxolane
CID 59883452

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol?
The IUPAC name of 2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol (CID 116518430) is 2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol.
What is the SMILES notation for 2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol?
The canonical SMILES for 2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol is CCC(CO)(c1ccccc1)C1CC1c1ccccc1.
What is the InChIKey of 2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol?
The InChIKey is OSXUGSYMUXDIPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c1-2-19(14-20,16-11-7-4-8-12-16)18-13-17(18)15-9-5-3-6-10-15/h3-12,17-18,20H,2,13-14H2,1H3.
What are the key properties of 2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol?
2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol has a molecular weight of 266.38 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol is sourced from PubChem (CID 116518430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).