1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol

C15H22O — CID 67579227

IUPAC1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol
SMILESCCc1ccc(C2(C(C)O)CC2)cc1CC
InChIInChI=1S/C15H22O/c1-4-12-6-7-14(10-13(12)5-2)15(8-9-15)11(3)16/h6-7,10-11,16H,4-5,8-9H2,1-3H3
InChIKeyUGTNTTULVIMZSB-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.22
Rot. Bonds4

About 1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol

1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol (PubChem CID 67579227) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol.

Molecular Properties

Compound Name1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol
PubChem CID67579227
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol
SMILESCCc1ccc(C2(C(C)O)CC2)cc1CC
InChIInChI=1S/C15H22O/c1-4-12-6-7-14(10-13(12)5-2)15(8-9-15)11(3)16/h6-7,10-11,16H,4-5,8-9H2,1-3H3
InChIKeyUGTNTTULVIMZSB-UHFFFAOYSA-N
XLogP3.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol?
The IUPAC name of 1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol (CID 67579227) is 1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol.
What is the SMILES notation for 1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol?
The canonical SMILES for 1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol is CCc1ccc(C2(C(C)O)CC2)cc1CC.
What is the InChIKey of 1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol?
The InChIKey is UGTNTTULVIMZSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-4-12-6-7-14(10-13(12)5-2)15(8-9-15)11(3)16/h6-7,10-11,16H,4-5,8-9H2,1-3H3.
What are the key properties of 1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol?
1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol has a molecular weight of 218.34 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(3,4-diethylphenyl)cyclopropyl]ethanol is sourced from PubChem (CID 67579227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).