6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid

C13H19N3O2 — CID 83015239

IUPAC6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid
SMILESCC1CCCC(C)N1Nc1ccc(C(=O)O)cn1
InChIInChI=1S/C13H19N3O2/c1-9-4-3-5-10(2)16(9)15-12-7-6-11(8-14-12)13(17)18/h6-10H,3-5H2,1-2H3,(H,14,15)(H,17,18)
InChIKeyGRANBVZQLOMHBE-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.37
Rot. Bonds3

About 6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid

6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid (PubChem CID 83015239) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid
PubChem CID83015239
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid
SMILESCC1CCCC(C)N1Nc1ccc(C(=O)O)cn1
InChIInChI=1S/C13H19N3O2/c1-9-4-3-5-10(2)16(9)15-12-7-6-11(8-14-12)13(17)18/h6-10H,3-5H2,1-2H3,(H,14,15)(H,17,18)
InChIKeyGRANBVZQLOMHBE-UHFFFAOYSA-N
XLogP2.37
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2,6-dimethylpiperidin-1-yl)amino]benzoic acid
CID 83016312
5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine
CID 83026801
2-N-(2,6-dimethylpiperidin-1-yl)pyridine-2,5-diamine
CID 83005795
6-(cyclopentylamino)pyridine-3-carboxylic acid
CID 1447952
(2,6-dimethylpiperidin-1-yl)-(6-hydrazinyl-3-pyridinyl)methanone
CID 62237680
6-(cyclopentanecarbonylamino)pyridine-3-carboxylic acid
CID 22099684
6-[(2,6-dimethylpiperidin-1-yl)amino]pyridazine-3-carboxamide
CID 83026892
6-[(1-methylpyrrolidin-3-yl)amino]pyridine-3-carboxylic acid
CID 61465352
2-N-(2,6-dimethylpiperidin-1-yl)pyrazine-2,5-diamine
CID 83024458
6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid
CID 62697960
6-hydrazinylpyridine-3-carboxylic acid
CID 3782617
6-[3-(cyclopropylamino)propylamino]pyridine-3-carboxylic acid
CID 61404521

Frequently Asked Questions

What is the IUPAC name of 6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid?
The IUPAC name of 6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid (CID 83015239) is 6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid is CC1CCCC(C)N1Nc1ccc(C(=O)O)cn1.
What is the InChIKey of 6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid?
The InChIKey is GRANBVZQLOMHBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-9-4-3-5-10(2)16(9)15-12-7-6-11(8-14-12)13(17)18/h6-10H,3-5H2,1-2H3,(H,14,15)(H,17,18).
What are the key properties of 6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid?
6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid has a molecular weight of 249.31 g/mol, XLogP of 2.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2,6-dimethylpiperidin-1-yl)amino]pyridine-3-carboxylic acid is sourced from PubChem (CID 83015239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).