2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid

C9H10F2N2O3 — CID 119006598

IUPAC2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid
SMILESCOc1cc(C(F)F)c(N)nc1CC(=O)O
InChIInChI=1S/C9H10F2N2O3/c1-16-6-2-4(8(10)11)9(12)13-5(6)3-7(14)15/h2,8H,3H2,1H3,(H2,12,13)(H,14,15)
InChIKeySRFNZYALJJMUKT-UHFFFAOYSA-N
MW232.19 g/mol
LogP1.24
Rot. Bonds4

About 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid

2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid (PubChem CID 119006598) has the molecular formula C9H10F2N2O3 and a molecular weight of 232.19 g/mol. Its IUPAC name is 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid.

Molecular Properties

Compound Name2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid
PubChem CID119006598
Molecular FormulaC9H10F2N2O3
Molecular Weight232.19 g/mol
Exact Mass232.07
IUPAC Name2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid
SMILESCOc1cc(C(F)F)c(N)nc1CC(=O)O
InChIInChI=1S/C9H10F2N2O3/c1-16-6-2-4(8(10)11)9(12)13-5(6)3-7(14)15/h2,8H,3H2,1H3,(H2,12,13)(H,14,15)
InChIKeySRFNZYALJJMUKT-UHFFFAOYSA-N
XLogP1.24
TPSA85.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.19
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]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-[6-(aminomethyl)-3-(difluoromethyl)-5-methoxy-2-pyridinyl]acetic acid
CID 133085224
2-[3-(difluoromethyl)-5,6-dimethoxy-2-pyridinyl]acetic acid
CID 134664061
2-[6-(difluoromethyl)-3-methoxy-5-(trifluoromethyl)-2-pyridinyl]acetic acid
CID 118826511
2-[3-(aminomethyl)-5-(difluoromethyl)-6-methoxy-2-pyridinyl]acetic acid
CID 133085247
methyl 2-[6-amino-5-(difluoromethyl)-3-hydroxy-2-pyridinyl]acetate
CID 133093457
methyl 2-[6-amino-3-chloro-5-(difluoromethyl)-2-pyridinyl]acetate
CID 134661772
6-chloro-3-(difluoromethyl)-5-methoxypyridin-2-amine
CID 130102532
methyl 2-[6-amino-5-(difluoromethyl)-2-methoxy-3-pyridinyl]acetate
CID 134684791
6-(chloromethyl)-3-(difluoromethyl)-5-methoxypyridine-2-carboxylic acid
CID 118804374
2-[6-bromo-3-(difluoromethyl)-4-methoxy-2-pyridinyl]acetic acid
CID 134671684
3-(difluoromethyl)-5-methoxy-6-(trifluoromethyl)pyridin-2-amine
CID 119019307
[6-amino-5-(difluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol
CID 119008282

Frequently Asked Questions

What is the IUPAC name of 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid?
The IUPAC name of 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid (CID 119006598) is 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid.
What is the SMILES notation for 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid?
The canonical SMILES for 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid is COc1cc(C(F)F)c(N)nc1CC(=O)O.
What is the InChIKey of 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid?
The InChIKey is SRFNZYALJJMUKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O3/c1-16-6-2-4(8(10)11)9(12)13-5(6)3-7(14)15/h2,8H,3H2,1H3,(H2,12,13)(H,14,15).
What are the key properties of 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid?
2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid has a molecular weight of 232.19 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-amino-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid is sourced from PubChem (CID 119006598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).