5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid

C13H19N3O3 — CID 102964148

IUPAC5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid
SMILESCOC1CN(c2ncc(C(=O)O)cc2N)CCC1C
InChIInChI=1S/C13H19N3O3/c1-8-3-4-16(7-11(8)19-2)12-10(14)5-9(6-15-12)13(17)18/h5-6,8,11H,3-4,7,14H2,1-2H3,(H,17,18)
InChIKeyYRBHSBMTZCWOFB-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.22
Rot. Bonds3

About 5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid

5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid (PubChem CID 102964148) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid
PubChem CID102964148
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid
SMILESCOC1CN(c2ncc(C(=O)O)cc2N)CCC1C
InChIInChI=1S/C13H19N3O3/c1-8-3-4-16(7-11(8)19-2)12-10(14)5-9(6-15-12)13(17)18/h5-6,8,11H,3-4,7,14H2,1-2H3,(H,17,18)
InChIKeyYRBHSBMTZCWOFB-UHFFFAOYSA-N
XLogP1.22
TPSA88.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-6-[3-(trifluoromethyl)pyrrolidin-1-yl]pyridine-3-carboxylic acid
CID 114271967
5-amino-6-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)pyridine-3-carboxylic acid
CID 81448030
methyl 3-amino-4-(3-methoxy-4-methylpiperidin-1-yl)benzoate
CID 102964150
5-amino-6-(4-methylpiperazin-1-yl)pyridine-3-carboxylic acid
CID 75355651
5-amino-6-(2,6-dimethylpiperidin-1-yl)pyridine-3-carboxylic acid
CID 81439379
4-(3-methoxy-4-methylpiperidin-1-yl)-6-methylpyridine-3-carboxylic acid
CID 102958647
3-chloro-4-(3-methoxy-4-methylpiperidin-1-yl)benzoic acid
CID 102965809
5-amino-6-(4-cyclopentylpiperazin-1-yl)pyridine-3-carboxylic acid
CID 81448228
2-(3-methoxy-4-methylpiperidin-1-yl)-4-methylpyridin-3-amine
CID 102955657
4-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid
CID 102958667
6-(3-methoxy-4-methylpiperidin-1-yl)-2,5-dimethylpyrimidin-4-amine
CID 102971402
1-(3-amino-5-methyl-2-pyridinyl)-3-methylpiperidin-4-ol
CID 114677696

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid?
The IUPAC name of 5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid (CID 102964148) is 5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid.
What is the SMILES notation for 5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid?
The canonical SMILES for 5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid is COC1CN(c2ncc(C(=O)O)cc2N)CCC1C.
What is the InChIKey of 5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid?
The InChIKey is YRBHSBMTZCWOFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-8-3-4-16(7-11(8)19-2)12-10(14)5-9(6-15-12)13(17)18/h5-6,8,11H,3-4,7,14H2,1-2H3,(H,17,18).
What are the key properties of 5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid?
5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid has a molecular weight of 265.31 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(3-methoxy-4-methylpiperidin-1-yl)pyridine-3-carboxylic acid is sourced from PubChem (CID 102964148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).