2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid

C15H20O3 — CID 66651942

IUPAC2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid
SMILESCOc1ccccc1C1CCCCC1CC(=O)O
InChIInChI=1S/C15H20O3/c1-18-14-9-5-4-8-13(14)12-7-3-2-6-11(12)10-15(16)17/h4-5,8-9,11-12H,2-3,6-7,10H2,1H3,(H,16,17)
InChIKeyAEMXUOJNDCKPJF-UHFFFAOYSA-N
MW248.32 g/mol
LogP3.44
Rot. Bonds4

About 2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid

2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid (PubChem CID 66651942) has the molecular formula C15H20O3 and a molecular weight of 248.32 g/mol. Its IUPAC name is 2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid.

Molecular Properties

Compound Name2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid
PubChem CID66651942
Molecular FormulaC15H20O3
Molecular Weight248.32 g/mol
Exact Mass248.14
IUPAC Name2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid
SMILESCOc1ccccc1C1CCCCC1CC(=O)O
InChIInChI=1S/C15H20O3/c1-18-14-9-5-4-8-13(14)12-7-3-2-6-11(12)10-15(16)17/h4-5,8-9,11-12H,2-3,6-7,10H2,1H3,(H,16,17)
InChIKeyAEMXUOJNDCKPJF-UHFFFAOYSA-N
XLogP3.44
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(2,5-dimethoxyphenyl)cyclopentyl]acetic acid
CID 66652406
1-[(1R,2R)-2-chlorocyclohexyl]-2-methoxybenzene
CID 101108843
3-methoxy-5-[[2-(2-methoxyphenyl)cyclohexyl]methoxy]pyridine
CID 90426351
2-[3-(2-methoxyphenyl)-2-bicyclo[2.2.1]hept-5-enyl]acetic acid
CID 66898843
2-[4-(2-methoxyphenyl)cyclohexen-1-yl]acetic acid
CID 175497484
[2-(2-fluoro-3-methoxyphenyl)cyclohexyl]methanamine
CID 82812472
2-(2-ethoxyphenyl)cyclohexane-1-carboxylic acid
CID 81008651
[4-(2-methoxyphenyl)piperidin-3-yl]methanol
CID 70454555
cis-(1R,2R)-2-(2-methoxyphenyl)cyclopropan-1-amine
CID 39235873
2-[4-(2-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]acetic acid
CID 82303598
2-[2-(2-methoxyethoxy)phenyl]cyclohexan-1-ol
CID 104662423
2-[9-(2-methoxyphenyl)-1,8-dioxo-3,4,5,6,7,9-hexahydro-2H-acridin-10-yl]acetic acid
CID 1149992

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid?
The IUPAC name of 2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid (CID 66651942) is 2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid.
What is the SMILES notation for 2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid?
The canonical SMILES for 2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid is COc1ccccc1C1CCCCC1CC(=O)O.
What is the InChIKey of 2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid?
The InChIKey is AEMXUOJNDCKPJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O3/c1-18-14-9-5-4-8-13(14)12-7-3-2-6-11(12)10-15(16)17/h4-5,8-9,11-12H,2-3,6-7,10H2,1H3,(H,16,17).
What are the key properties of 2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid?
2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid has a molecular weight of 248.32 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyphenyl)cyclohexyl]acetic acid is sourced from PubChem (CID 66651942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).