6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid

C9H11N3O3 — CID 83023717

IUPAC6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid
SMILESCN(C)NC(=O)c1cccc(C(=O)O)n1
InChIInChI=1S/C9H11N3O3/c1-12(2)11-8(13)6-4-3-5-7(10-6)9(14)15/h3-5H,1-2H3,(H,11,13)(H,14,15)
InChIKeyUIJVKTCPRCFSCT-UHFFFAOYSA-N
MW209.21 g/mol
LogP-0.01
Rot. Bonds3

About 6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid

6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid (PubChem CID 83023717) has the molecular formula C9H11N3O3 and a molecular weight of 209.21 g/mol. Its IUPAC name is 6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid
PubChem CID83023717
Molecular FormulaC9H11N3O3
Molecular Weight209.21 g/mol
Exact Mass209.08
IUPAC Name6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid
SMILESCN(C)NC(=O)c1cccc(C(=O)O)n1
InChIInChI=1S/C9H11N3O3/c1-12(2)11-8(13)6-4-3-5-7(10-6)9(14)15/h3-5H,1-2H3,(H,11,13)(H,14,15)
InChIKeyUIJVKTCPRCFSCT-UHFFFAOYSA-N
XLogP-0.01
TPSA82.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.21
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 6-(dimethylaminocarbamoyl)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

CID 91986542
CID 91986542
6-(tert-butylcarbamoyl)pyridine-2-carboxylic acid
CID 43558262
dysprosium;tris(6-(ethylcarbamoyl)pyridine-2-carboxylic acid)
CID 139213338
6-[(2,6-dimethylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 43558422
6-(dimethylamino)pyridine-2-carboxylic acid
CID 53408411
6-[(3-methylcyclobutyl)carbamoyl]pyridine-2-carboxylic acid
CID 115910448
6-[(2,6-dibromophenyl)carbamoyl]pyridine-2-carboxylic acid
CID 107602474
6-[(2-chloro-6-methylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 66254491
6-(2,2-difluoroethylcarbamoyl)pyridine-2-carboxylic acid
CID 115408328
6-[methyl(pyridin-4-yl)carbamoyl]pyridine-2-carboxylic acid
CID 106936576
2-N,2-N,6-N,6-N-tetramethylpyridine-2,6-dicarboxamide
CID 10955130
6-[(5-methyl-1,2,4-oxadiazol-3-yl)methylcarbamoyl]pyridine-2-carboxylic acid
CID 103790332

Frequently Asked Questions

What is the IUPAC name of 6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid?
The IUPAC name of 6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid (CID 83023717) is 6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid is CN(C)NC(=O)c1cccc(C(=O)O)n1.
What is the InChIKey of 6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid?
The InChIKey is UIJVKTCPRCFSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3/c1-12(2)11-8(13)6-4-3-5-7(10-6)9(14)15/h3-5H,1-2H3,(H,11,13)(H,14,15).
What are the key properties of 6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid?
6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid has a molecular weight of 209.21 g/mol, XLogP of -0.01, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylaminocarbamoyl)pyridine-2-carboxylic acid is sourced from PubChem (CID 83023717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).