methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate

C12H14O4 — CID 105478906

IUPACmethyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate
SMILESCOC(=O)C1(c2cc(O)ccc2OC)CC1
InChIInChI=1S/C12H14O4/c1-15-10-4-3-8(13)7-9(10)12(5-6-12)11(14)16-2/h3-4,7,13H,5-6H2,1-2H3
InChIKeySGVNVJYXAATBKG-UHFFFAOYSA-N
MW222.24 g/mol
LogP1.61
Rot. Bonds3

About methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate

methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate (PubChem CID 105478906) has the molecular formula C12H14O4 and a molecular weight of 222.24 g/mol. Its IUPAC name is methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate.

Molecular Properties

Compound Namemethyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate
PubChem CID105478906
Molecular FormulaC12H14O4
Molecular Weight222.24 g/mol
Exact Mass222.09
IUPAC Namemethyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate
SMILESCOC(=O)C1(c2cc(O)ccc2OC)CC1
InChIInChI=1S/C12H14O4/c1-15-10-4-3-8(13)7-9(10)12(5-6-12)11(14)16-2/h3-4,7,13H,5-6H2,1-2H3
InChIKeySGVNVJYXAATBKG-UHFFFAOYSA-N
XLogP1.61
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate 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

methyl 1-(2,3-dimethoxyphenyl)cyclopropane-1-carboxylate
CID 105497539
methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate
CID 116964044
methyl 1-(4-hydroxy-3-methoxyphenyl)cyclopentane-1-carboxylate
CID 146506690
1-(5-tert-butyl-2-methoxyphenyl)cyclopropane-1-carboxylic acid
CID 82296346
methyl 1-(2-amino-5-bromophenyl)cyclopropane-1-carboxylate
CID 170008442
methyl 1-(4-methoxy-3-nitrophenyl)cyclopropane-1-carboxylate
CID 59129309
methyl 4-(2,5-difluoro-3-methoxyphenyl)oxane-4-carboxylate
CID 11403422
methyl 1-(2-fluoro-5-methoxy-4-trimethylstannylphenyl)cyclopropane-1-carboxylate
CID 140648492
methyl 1-(3-bromo-4-methoxyphenyl)cyclobutane-1-carboxylate
CID 116963863
methyl 1-(5-chloro-2-fluorophenyl)cyclopropane-1-carboxylate
CID 116964008
methyl 3-hydroxy-7-methylbicyclo[4.2.0]octa-1(6),2,4-triene-7-carboxylate
CID 170914878
methyl 1-(3-chloro-4-methoxyphenyl)cyclobutane-1-carboxylate
CID 116963848

Frequently Asked Questions

What is the IUPAC name of methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate?
The IUPAC name of methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate (CID 105478906) is methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate.
What is the SMILES notation for methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate?
The canonical SMILES for methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate is COC(=O)C1(c2cc(O)ccc2OC)CC1.
What is the InChIKey of methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate?
The InChIKey is SGVNVJYXAATBKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O4/c1-15-10-4-3-8(13)7-9(10)12(5-6-12)11(14)16-2/h3-4,7,13H,5-6H2,1-2H3.
What are the key properties of methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate?
methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate has a molecular weight of 222.24 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-(5-hydroxy-2-methoxyphenyl)cyclopropane-1-carboxylate is sourced from PubChem (CID 105478906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).