1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol

C14H20O — CID 118556578

IUPAC1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol
SMILESCC(c1ccccc1)C1CC1(C)C(C)O
InChIInChI=1S/C14H20O/c1-10(12-7-5-4-6-8-12)13-9-14(13,3)11(2)15/h4-8,10-11,13,15H,9H2,1-3H3
InChIKeyGOVFHSJWKJPKRE-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.20
Rot. Bonds3

About 1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol

1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol (PubChem CID 118556578) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol.

Molecular Properties

Compound Name1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol
PubChem CID118556578
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol
SMILESCC(c1ccccc1)C1CC1(C)C(C)O
InChIInChI=1S/C14H20O/c1-10(12-7-5-4-6-8-12)13-9-14(13,3)11(2)15/h4-8,10-11,13,15H,9H2,1-3H3
InChIKeyGOVFHSJWKJPKRE-UHFFFAOYSA-N
XLogP3.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol?
The IUPAC name of 1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol (CID 118556578) is 1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol.
What is the SMILES notation for 1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol?
The canonical SMILES for 1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol is CC(c1ccccc1)C1CC1(C)C(C)O.
What is the InChIKey of 1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol?
The InChIKey is GOVFHSJWKJPKRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-10(12-7-5-4-6-8-12)13-9-14(13,3)11(2)15/h4-8,10-11,13,15H,9H2,1-3H3.
What are the key properties of 1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol?
1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol has a molecular weight of 204.31 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-methyl-2-(1-phenylethyl)cyclopropyl]ethanol is sourced from PubChem (CID 118556578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).