methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate

C15H20O4 — CID 116964044

IUPACmethyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate
SMILESCOC(=O)C1(c2cc(OC)c(C)c(C)c2OC)CC1
InChIInChI=1S/C15H20O4/c1-9-10(2)13(18-4)11(8-12(9)17-3)15(6-7-15)14(16)19-5/h8H,6-7H2,1-5H3
InChIKeyLCJOZGCYCMYSAT-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.53
Rot. Bonds4

About methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate

methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate (PubChem CID 116964044) has the molecular formula C15H20O4 and a molecular weight of 264.32 g/mol. Its IUPAC name is methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate.

Molecular Properties

Compound Namemethyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate
PubChem CID116964044
Molecular FormulaC15H20O4
Molecular Weight264.32 g/mol
Exact Mass264.14
IUPAC Namemethyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate
SMILESCOC(=O)C1(c2cc(OC)c(C)c(C)c2OC)CC1
InChIInChI=1S/C15H20O4/c1-9-10(2)13(18-4)11(8-12(9)17-3)15(6-7-15)14(16)19-5/h8H,6-7H2,1-5H3
InChIKeyLCJOZGCYCMYSAT-UHFFFAOYSA-N
XLogP2.53
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-hydroxy-5-methoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylic acid
CID 117344803
methyl 1-(2,3-dimethoxyphenyl)cyclopropane-1-carboxylate
CID 105497539
methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate
CID 105478906
methyl 1-(2-fluoro-5-methoxy-4-trimethylstannylphenyl)cyclopropane-1-carboxylate
CID 140648492
1-(2,5-dimethoxy-3,4-dimethylphenyl)-2-methylcyclopropane-1-carboxylic acid
CID 116842907
1-(4,5-dimethoxy-2-methylphenyl)cyclopropane-1-carboxylic acid
CID 82496751
methyl 1-(2-methoxy-4,6-dimethylphenyl)cyclopropane-1-carboxylate
CID 116964011
3-(2,5-dimethoxy-3,4-dimethylphenyl)oxetan-3-ol
CID 116873054
methyl 1-(5-chloro-2-fluorophenyl)cyclopropane-1-carboxylate
CID 116964008
[1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclobutyl]methanamine
CID 117377054
1-(5-fluoro-2,3-dimethoxyphenyl)cyclopropane-1-carboxylic acid
CID 117352658
methyl 1-(5-bromo-2-methylphenyl)cyclopropane-1-carboxylate
CID 116964024

Frequently Asked Questions

What is the IUPAC name of methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate?
The IUPAC name of methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate (CID 116964044) is methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate.
What is the SMILES notation for methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate?
The canonical SMILES for methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate is COC(=O)C1(c2cc(OC)c(C)c(C)c2OC)CC1.
What is the InChIKey of methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate?
The InChIKey is LCJOZGCYCMYSAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O4/c1-9-10(2)13(18-4)11(8-12(9)17-3)15(6-7-15)14(16)19-5/h8H,6-7H2,1-5H3.
What are the key properties of methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate?
methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate has a molecular weight of 264.32 g/mol, XLogP of 2.53, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate is sourced from PubChem (CID 116964044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).