2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol

C13H18O — CID 79332541

IUPAC2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol
SMILESCC(C)c1ccc(C2(O)CC2C)cc1
InChIInChI=1S/C13H18O/c1-9(2)11-4-6-12(7-5-11)13(14)8-10(13)3/h4-7,9-10,14H,8H2,1-3H3
InChIKeyAEWZQYJMZDJSIQ-UHFFFAOYSA-N
MW190.29 g/mol
LogP3.04
Rot. Bonds2

About 2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol

2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol (PubChem CID 79332541) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol.

Molecular Properties

Compound Name2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol
PubChem CID79332541
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol
SMILESCC(C)c1ccc(C2(O)CC2C)cc1
InChIInChI=1S/C13H18O/c1-9(2)11-4-6-12(7-5-11)13(14)8-10(13)3/h4-7,9-10,14H,8H2,1-3H3
InChIKeyAEWZQYJMZDJSIQ-UHFFFAOYSA-N
XLogP3.04
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol?
The IUPAC name of 2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol (CID 79332541) is 2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol.
What is the SMILES notation for 2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol?
The canonical SMILES for 2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol is CC(C)c1ccc(C2(O)CC2C)cc1.
What is the InChIKey of 2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol?
The InChIKey is AEWZQYJMZDJSIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O/c1-9(2)11-4-6-12(7-5-11)13(14)8-10(13)3/h4-7,9-10,14H,8H2,1-3H3.
What are the key properties of 2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol?
2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol has a molecular weight of 190.29 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol is sourced from PubChem (CID 79332541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).