1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol

C13H18O — CID 117282039

IUPAC1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol
SMILESCc1cc(C2(O)CC2)c(C)c(C)c1C
InChIInChI=1S/C13H18O/c1-8-7-12(13(14)5-6-13)11(4)10(3)9(8)2/h7,14H,5-6H2,1-4H3
InChIKeyDXQJMKZIGUBXLG-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.90
Rot. Bonds1

About 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol

1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol (PubChem CID 117282039) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol
PubChem CID117282039
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol
SMILESCc1cc(C2(O)CC2)c(C)c(C)c1C
InChIInChI=1S/C13H18O/c1-8-7-12(13(14)5-6-13)11(4)10(3)9(8)2/h7,14H,5-6H2,1-4H3
InChIKeyDXQJMKZIGUBXLG-UHFFFAOYSA-N
XLogP2.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(7,8-dimethyl-2,3-dihydro-1,4-benzodioxin-5-yl)cyclopropan-1-ol
CID 117314195
1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol
CID 84768148
4-(1-hydroxycyclopropyl)-3-methoxy-2,6-dimethylphenol
CID 84780188
1-(2,4,5-trimethylphenyl)cycloheptan-1-ol
CID 64985087
1-(5-fluoro-3,4-dimethoxy-2-methylphenyl)cyclopropan-1-ol
CID 117325333
3,3-dimethyl-1-(2,4,5-trimethylphenyl)cyclopentan-1-ol
CID 80699117
1-(2-amino-5-fluoro-4-methylphenyl)cyclopropan-1-ol
CID 168788223
1-(5-chloro-4-fluoro-2-methylphenyl)cyclopropan-1-ol
CID 117289605
1-(2-fluoro-3-methylphenyl)cyclopropan-1-ol
CID 81477688
4-(1-hydroxycyclopropyl)-2,3,5-trimethylphenol
CID 117117396
2-(1-hydroxycyclopropyl)-4-methoxy-6-methylphenol
CID 117284601
2-(1-hydroxycyclopropyl)-5-methylsulfonylphenol
CID 117328849

Frequently Asked Questions

What is the IUPAC name of 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol?
The IUPAC name of 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol (CID 117282039) is 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol.
What is the SMILES notation for 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol?
The canonical SMILES for 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol is Cc1cc(C2(O)CC2)c(C)c(C)c1C.
What is the InChIKey of 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol?
The InChIKey is DXQJMKZIGUBXLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O/c1-8-7-12(13(14)5-6-13)11(4)10(3)9(8)2/h7,14H,5-6H2,1-4H3.
What are the key properties of 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol?
1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol has a molecular weight of 190.29 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol is sourced from PubChem (CID 117282039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).