5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid

C10H13N3O3 — CID 104638770

IUPAC5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid
SMILESCNC(=O)CN(C)c1ccc(C(=O)O)nc1
InChIInChI=1S/C10H13N3O3/c1-11-9(14)6-13(2)7-3-4-8(10(15)16)12-5-7/h3-5H,6H2,1-2H3,(H,11,14)(H,15,16)
InChIKeyAXXSXIXGXPTEHJ-UHFFFAOYSA-N
MW223.23 g/mol
LogP-0.04
Rot. Bonds4

About 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid

5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid (PubChem CID 104638770) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid
PubChem CID104638770
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC Name5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid
SMILESCNC(=O)CN(C)c1ccc(C(=O)O)nc1
InChIInChI=1S/C10H13N3O3/c1-11-9(14)6-13(2)7-3-4-8(10(15)16)12-5-7/h3-5H,6H2,1-2H3,(H,11,14)(H,15,16)
InChIKeyAXXSXIXGXPTEHJ-UHFFFAOYSA-N
XLogP-0.04
TPSA82.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic 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

5-[methyl-[3-(methylamino)-3-oxopropyl]amino]pyridine-2-carboxylic acid
CID 106916049
2-[[6-(aminomethyl)-3-pyridinyl]-methylamino]-N-methylacetamide
CID 115486849
5-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]pyridine-2-carboxylic acid
CID 105418652
5-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid
CID 104638828
2-[(6-carbamothioyl-3-pyridinyl)-methylamino]-N-propan-2-ylacetamide
CID 113320870
2-(4-tert-butyl-N-methylanilino)-N-methylacetamide
CID 60562398
methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate
CID 103772153
5-[methyl(thiophen-3-ylmethyl)amino]pyridine-2-carboxylic acid
CID 115490786
5-[(2-chlorophenyl)methyl-methylamino]pyridine-2-carboxylic acid
CID 113321608
5-(4-ethyl-N-methylanilino)pyridine-2-carboxylic acid
CID 113321588
5-[methyl(2-thiophen-2-ylethyl)amino]pyridine-2-carboxylic acid
CID 113321661
2-[4-(1-hydroxyethyl)-N-methylanilino]-N-methylacetamide
CID 43506218

Frequently Asked Questions

What is the IUPAC name of 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid?
The IUPAC name of 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid (CID 104638770) is 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid?
The canonical SMILES for 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid is CNC(=O)CN(C)c1ccc(C(=O)O)nc1.
What is the InChIKey of 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid?
The InChIKey is AXXSXIXGXPTEHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c1-11-9(14)6-13(2)7-3-4-8(10(15)16)12-5-7/h3-5H,6H2,1-2H3,(H,11,14)(H,15,16).
What are the key properties of 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid?
5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid has a molecular weight of 223.23 g/mol, XLogP of -0.04, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 104638770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).