methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate

C15H20O3 — CID 83929095

IUPACmethyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate
SMILESCOC(=O)C1CC1CC(C)c1ccccc1OC
InChIInChI=1S/C15H20O3/c1-10(8-11-9-13(11)15(16)18-3)12-6-4-5-7-14(12)17-2/h4-7,10-11,13H,8-9H2,1-3H3
InChIKeyAEYSRDOUKVOFTM-UHFFFAOYSA-N
MW248.32 g/mol
LogP3.00
Rot. Bonds5

About methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate

methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate (PubChem CID 83929095) has the molecular formula C15H20O3 and a molecular weight of 248.32 g/mol. Its IUPAC name is methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate.

Molecular Properties

Compound Namemethyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate
PubChem CID83929095
Molecular FormulaC15H20O3
Molecular Weight248.32 g/mol
Exact Mass248.14
IUPAC Namemethyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate
SMILESCOC(=O)C1CC1CC(C)c1ccccc1OC
InChIInChI=1S/C15H20O3/c1-10(8-11-9-13(11)15(16)18-3)12-6-4-5-7-14(12)17-2/h4-7,10-11,13H,8-9H2,1-3H3
InChIKeyAEYSRDOUKVOFTM-UHFFFAOYSA-N
XLogP3.00
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[2-(4-methoxy-2,5-dimethylphenyl)propyl]cyclopropane-1-carboxylate
CID 83927871
methyl 2-[2-(2,3-difluorophenyl)propyl]cyclopropane-1-carboxylate
CID 83925556
methyl 2-[2-[2-(2-methylpropoxy)phenyl]butyl]cyclopropane-1-carboxylate
CID 83932519
methyl 2-[2-(4-ethoxy-3-methoxyphenyl)propyl]cyclopropane-1-carboxylate
CID 83938424
methyl 2-[2-(4-fluorophenyl)propyl]cyclopropane-1-carboxylate
CID 83931003
methyl 2-[2-(4-hydroxyphenyl)propyl]cyclopropane-1-carboxylate
CID 83930458
methyl 2-[2-(5-tert-butyl-2-methylphenyl)propyl]cyclopropane-1-carboxylate
CID 83935426
methyl 2-[2-(4-tert-butylphenyl)propyl]cyclopropane-1-carboxylate
CID 83928797
methyl 2-[2-(5-methyl-2-propoxyphenyl)propyl]cyclopropane-1-carboxylate
CID 83933599
methyl 2-[2-(2,3,6-trichlorophenyl)propyl]cyclopropane-1-carboxylate
CID 83925208
trans-methyl (1R,2R)-2-benzylcyclopropane-1-carboxylate
CID 71409329
methyl 2-[2-(3-propan-2-ylsulfonylphenyl)propyl]cyclopropane-1-carboxylate
CID 83927024

Frequently Asked Questions

What is the IUPAC name of methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate?
The IUPAC name of methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate (CID 83929095) is methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate.
What is the SMILES notation for methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate?
The canonical SMILES for methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate is COC(=O)C1CC1CC(C)c1ccccc1OC.
What is the InChIKey of methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate?
The InChIKey is AEYSRDOUKVOFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O3/c1-10(8-11-9-13(11)15(16)18-3)12-6-4-5-7-14(12)17-2/h4-7,10-11,13H,8-9H2,1-3H3.
What are the key properties of methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate?
methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate has a molecular weight of 248.32 g/mol, XLogP of 3.00, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[2-(2-methoxyphenyl)propyl]cyclopropane-1-carboxylate is sourced from PubChem (CID 83929095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).