2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid

C11H10ClFO4 — CID 117405942

IUPAC2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid
SMILESO=C(O)C(O)c1cc(F)cc(Cl)c1OC1CC1
InChIInChI=1S/C11H10ClFO4/c12-8-4-5(13)3-7(9(14)11(15)16)10(8)17-6-1-2-6/h3-4,6,9,14H,1-2H2,(H,15,16)
InChIKeyRMKMZDXHHDGBGQ-UHFFFAOYSA-N
MW260.65 g/mol
LogP2.14
Rot. Bonds4

About 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid

2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid (PubChem CID 117405942) has the molecular formula C11H10ClFO4 and a molecular weight of 260.65 g/mol. Its IUPAC name is 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid.

Molecular Properties

Compound Name2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid
PubChem CID117405942
Molecular FormulaC11H10ClFO4
Molecular Weight260.65 g/mol
Exact Mass260.03
IUPAC Name2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid
SMILESO=C(O)C(O)c1cc(F)cc(Cl)c1OC1CC1
InChIInChI=1S/C11H10ClFO4/c12-8-4-5(13)3-7(9(14)11(15)16)10(8)17-6-1-2-6/h3-4,6,9,14H,1-2H2,(H,15,16)
InChIKeyRMKMZDXHHDGBGQ-UHFFFAOYSA-N
XLogP2.14
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.65
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid 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

2-(3-chloro-2-cyclopropyloxy-5-methylphenyl)-2-hydroxyacetic acid
CID 117394961
1-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-(methylamino)ethanol
CID 117403462
2-amino-3-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)propanoic acid
CID 117436914
2-(3-chloro-5-fluoro-2-hydroxyphenyl)-2-hydroxyacetic acid
CID 117314960
2-(3-chloro-5-fluoro-2-methylphenyl)-2-hydroxyacetic acid
CID 117311528
2-amino-2-(2-cyclopropyloxy-5-fluoro-3-methoxyphenyl)acetic acid
CID 117390658
2-[2-(difluoromethoxy)-5-fluoro-3-formylphenyl]-2-hydroxyacetic acid
CID 171026260
3-amino-2-(2-cyclopropyloxy-5-fluoro-3-methoxyphenyl)propanoic acid
CID 117426162
(2R)-2-hydroxy-2-(2,3,5-trifluorophenyl)acetic acid
CID 70080177
2-(3-chloro-5-cyclopentyloxy-4-methoxyphenyl)-2-hydroxyacetic acid
CID 117484437
[4-[2-[4-(2,6-dichloro-4-fluorophenoxy)piperidin-1-yl]ethyl]cyclohexyl]carbamic acid
CID 71268437
2-amino-1-(3-bromo-2-cyclopropyloxy-5-fluorophenyl)ethanol
CID 117468296

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid?
The IUPAC name of 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid (CID 117405942) is 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid.
What is the SMILES notation for 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid?
The canonical SMILES for 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid is O=C(O)C(O)c1cc(F)cc(Cl)c1OC1CC1.
What is the InChIKey of 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid?
The InChIKey is RMKMZDXHHDGBGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClFO4/c12-8-4-5(13)3-7(9(14)11(15)16)10(8)17-6-1-2-6/h3-4,6,9,14H,1-2H2,(H,15,16).
What are the key properties of 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid?
2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid has a molecular weight of 260.65 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-2-cyclopropyloxy-5-fluorophenyl)-2-hydroxyacetic acid is sourced from PubChem (CID 117405942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).