methyl 2-(2-cyclopentylphenyl)acetate

C14H18O2 — CID 117047538

IUPACmethyl 2-(2-cyclopentylphenyl)acetate
SMILESCOC(=O)Cc1ccccc1C1CCCC1
InChIInChI=1S/C14H18O2/c1-16-14(15)10-12-8-4-5-9-13(12)11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7,10H2,1H3
InChIKeySFUAYTYFNDWYQL-UHFFFAOYSA-N
MW218.30 g/mol
LogP3.06
Rot. Bonds3

About methyl 2-(2-cyclopentylphenyl)acetate

methyl 2-(2-cyclopentylphenyl)acetate (PubChem CID 117047538) has the molecular formula C14H18O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is methyl 2-(2-cyclopentylphenyl)acetate.

Molecular Properties

Compound Namemethyl 2-(2-cyclopentylphenyl)acetate
PubChem CID117047538
Molecular FormulaC14H18O2
Molecular Weight218.30 g/mol
Exact Mass218.13
IUPAC Namemethyl 2-(2-cyclopentylphenyl)acetate
SMILESCOC(=O)Cc1ccccc1C1CCCC1
InChIInChI=1S/C14H18O2/c1-16-14(15)10-12-8-4-5-9-13(12)11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7,10H2,1H3
InChIKeySFUAYTYFNDWYQL-UHFFFAOYSA-N
XLogP3.06
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 5-(2-cyclobutylphenyl)-4-oxopentanoate
CID 114605935
1-(2-cyclopentylphenyl)propan-2-one
CID 83832084
methyl 2-(4-cyclohexylnaphthalen-1-yl)acetate
CID 23346484
2-(2-cyclopentylphenyl)acetamide
CID 68862878
methyl 2-[(2-cyclopropylphenyl)methylamino]acetate
CID 79978808
methyl 2-[2-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]phenyl]acetate
CID 170984965
methyl 2-[2-[(cycloheptylamino)methyl]phenyl]acetate
CID 115461578
methyl 2-(4-chloro-2-cyclopropylphenyl)acetate
CID 174254257
methyl 2-(4-cycloheptylphenyl)acetate
CID 54417181
1-(2-cyclopentylphenyl)propan-2-ol
CID 117292896
methyl 2-[2-[[methyl-(2-methylcyclohexyl)amino]methyl]phenyl]acetate
CID 115462776
methyl 2-[2-[[[(1R)-1-cyclohexylethyl]amino]methyl]phenyl]acetate
CID 115462242

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2-cyclopentylphenyl)acetate?
The IUPAC name of methyl 2-(2-cyclopentylphenyl)acetate (CID 117047538) is methyl 2-(2-cyclopentylphenyl)acetate.
What is the SMILES notation for methyl 2-(2-cyclopentylphenyl)acetate?
The canonical SMILES for methyl 2-(2-cyclopentylphenyl)acetate is COC(=O)Cc1ccccc1C1CCCC1.
What is the InChIKey of methyl 2-(2-cyclopentylphenyl)acetate?
The InChIKey is SFUAYTYFNDWYQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O2/c1-16-14(15)10-12-8-4-5-9-13(12)11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7,10H2,1H3.
What are the key properties of methyl 2-(2-cyclopentylphenyl)acetate?
methyl 2-(2-cyclopentylphenyl)acetate has a molecular weight of 218.30 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-cyclopentylphenyl)acetate is sourced from PubChem (CID 117047538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).