2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid

C14H13FN2O3 — CID 118002510

IUPAC2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid
SMILESCOc1cccc(F)c1-c1ccncc1NCC(=O)O
InChIInChI=1S/C14H13FN2O3/c1-20-12-4-2-3-10(15)14(12)9-5-6-16-7-11(9)17-8-13(18)19/h2-7,17H,8H2,1H3,(H,18,19)
InChIKeyXGWKTEUJKRKNHW-UHFFFAOYSA-N
MW276.27 g/mol
LogP2.39
Rot. Bonds5

About 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid

2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid (PubChem CID 118002510) has the molecular formula C14H13FN2O3 and a molecular weight of 276.27 g/mol. Its IUPAC name is 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid
PubChem CID118002510
Molecular FormulaC14H13FN2O3
Molecular Weight276.27 g/mol
Exact Mass276.09
IUPAC Name2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid
SMILESCOc1cccc(F)c1-c1ccncc1NCC(=O)O
InChIInChI=1S/C14H13FN2O3/c1-20-12-4-2-3-10(15)14(12)9-5-6-16-7-11(9)17-8-13(18)19/h2-7,17H,8H2,1H3,(H,18,19)
InChIKeyXGWKTEUJKRKNHW-UHFFFAOYSA-N
XLogP2.39
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.27
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic 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

methyl 5-(2-fluoro-6-methoxyphenyl)pyrimidine-4-carboxylate
CID 163390834
(2-fluoro-6-methoxyphenyl)-isoquinolin-8-ylmethanone
CID 103134021
2-[(3,8-dimethoxynaphthalen-2-yl)amino]acetic acid
CID 66808047
3-(2,6-dimethoxyphenyl)pyridine-4-carboxylic acid
CID 112694211
6-fluoro-9-methoxybenzo[g]isoquinoline-5,10-dione
CID 10706275
2-[(3-methoxy-2-pyridinyl)amino]acetic acid
CID 83828470
2-(2-fluoroanilino)-1-(2-methoxyphenyl)ethanone
CID 94272670
N-(3-fluoro-4-pyridinyl)-2-hydroxy-3-methoxybenzamide
CID 103874422
1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene
CID 46312197
N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide
CID 140628304
3-[tert-butyl-(2-fluoro-6-methoxybenzoyl)amino]propanoic acid
CID 65434948
N-[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]-N-(2-methoxyethyl)-3-methylsulfonyl-5-(trifluoromethyl)benzamide
CID 70663563

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid?
The IUPAC name of 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid (CID 118002510) is 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid.
What is the SMILES notation for 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid?
The canonical SMILES for 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid is COc1cccc(F)c1-c1ccncc1NCC(=O)O.
What is the InChIKey of 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid?
The InChIKey is XGWKTEUJKRKNHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O3/c1-20-12-4-2-3-10(15)14(12)9-5-6-16-7-11(9)17-8-13(18)19/h2-7,17H,8H2,1H3,(H,18,19).
What are the key properties of 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid?
2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid has a molecular weight of 276.27 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(2-fluoro-6-methoxyphenyl)-3-pyridinyl]amino]acetic acid is sourced from PubChem (CID 118002510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).