2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid

C15H12Cl2N2O4 — CID 99697568

IUPAC2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid
SMILESCN(CC(=O)O)C(=O)c1cccnc1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H12Cl2N2O4/c1-19(8-13(20)21)15(22)10-3-2-6-18-14(10)23-12-5-4-9(16)7-11(12)17/h2-7H,8H2,1H3,(H,20,21)
InChIKeyVAUSDXQLFWSCDD-UHFFFAOYSA-N
MW355.18 g/mol
LogP3.34
Rot. Bonds5

About 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid

2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid (PubChem CID 99697568) has the molecular formula C15H12Cl2N2O4 and a molecular weight of 355.18 g/mol. Its IUPAC name is 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid.

Molecular Properties

Compound Name2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid
PubChem CID99697568
Molecular FormulaC15H12Cl2N2O4
Molecular Weight355.18 g/mol
Exact Mass354.02
IUPAC Name2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid
SMILESCN(CC(=O)O)C(=O)c1cccnc1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H12Cl2N2O4/c1-19(8-13(20)21)15(22)10-3-2-6-18-14(10)23-12-5-4-9(16)7-11(12)17/h2-7H,8H2,1H3,(H,20,21)
InChIKeyVAUSDXQLFWSCDD-UHFFFAOYSA-N
XLogP3.34
TPSA79.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.18
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]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

2-(2,4-dichlorophenoxy)pyridine-3-carbonyl chloride
CID 170944074
2-(2,4-dichlorophenoxy)-N-methyl-N-pyrrolidin-3-ylpyridine-3-carboxamide;dihydrochloride
CID 119554680
2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide
CID 46194702
2-[methyl-[2-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]amino]acetic acid
CID 99697580
[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-[2-(2,4-dichlorophenoxy)-3-pyridinyl]methanone;dihydrochloride
CID 120659391
2-(2,4-dichlorophenoxy)-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
CID 119514700
3-(chloromethyl)-2-(2,4-dichlorophenoxy)pyridine
CID 61268068
2-(2,5-dichlorophenoxy)-N-methyl-N-(2-phenylphenyl)pyridine-3-carboxamide
CID 59294533
2-(4-chloro-2-methoxyphenoxy)pyridine-3-carboxylic acid
CID 67533760
(4-amino-3,3-dimethylpiperidin-1-yl)-[2-(2,4-dichlorophenoxy)-3-pyridinyl]methanone;dihydrochloride
CID 120818027
2-(4-chlorophenoxy)-N-(1,3-dioxolan-2-ylmethyl)-N-methylpyridine-3-carboxamide
CID 44757541
2-(2,5-dichlorophenoxy)-N-(2-methoxy-5-methylphenyl)-N-methylpyridine-3-carboxamide
CID 59294517

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid?
The IUPAC name of 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid (CID 99697568) is 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid.
What is the SMILES notation for 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid?
The canonical SMILES for 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid is CN(CC(=O)O)C(=O)c1cccnc1Oc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid?
The InChIKey is VAUSDXQLFWSCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O4/c1-19(8-13(20)21)15(22)10-3-2-6-18-14(10)23-12-5-4-9(16)7-11(12)17/h2-7H,8H2,1H3,(H,20,21).
What are the key properties of 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid?
2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid has a molecular weight of 355.18 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2,4-dichlorophenoxy)pyridine-3-carbonyl]-methylamino]acetic acid is sourced from PubChem (CID 99697568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).