3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid

C14H21N3O2 — CID 83061885

IUPAC3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid
SMILESCCCC1CCCCN1c1nccc(C(=O)O)c1N
InChIInChI=1S/C14H21N3O2/c1-2-5-10-6-3-4-9-17(10)13-12(15)11(14(18)19)7-8-16-13/h7-8,10H,2-6,9,15H2,1H3,(H,18,19)
InChIKeyVINWLVLHUOTDCF-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.52
Rot. Bonds4

About 3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid

3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid (PubChem CID 83061885) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid.

Molecular Properties

Compound Name3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid
PubChem CID83061885
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid
SMILESCCCC1CCCCN1c1nccc(C(=O)O)c1N
InChIInChI=1S/C14H21N3O2/c1-2-5-10-6-3-4-9-17(10)13-12(15)11(14(18)19)7-8-16-13/h7-8,10H,2-6,9,15H2,1H3,(H,18,19)
InChIKeyVINWLVLHUOTDCF-UHFFFAOYSA-N
XLogP2.52
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-propylpiperidin-1-yl)pyrazin-2-amine
CID 104577126
3-(2-propylpiperidin-1-yl)pyrazine-2-carbothioamide
CID 83055369
5-methyl-6-(2-propylpiperidin-1-yl)pyridine-3-carboxylic acid
CID 83055806
3-amino-2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)pyridine-4-carboxylic acid
CID 79170719
3-amino-2-(3,4-dimethylpyrrolidin-1-yl)pyridine-4-carboxylic acid
CID 79181195
2-chloro-4-(2-propylpiperidin-1-yl)pyridine
CID 104577128
5-propyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-amine
CID 83057694
5-bromo-2-(2-propylpiperidin-1-yl)pyridin-3-amine
CID 83052128
3-amino-2-[3-(methylcarbamoyl)piperidin-1-yl]pyridine-4-carboxylic acid
CID 103197754
3-amino-2-[2-(hydroxymethyl)piperidin-1-yl]pyridine-4-carbonitrile
CID 82817295
1-[2-(2-ethylazepan-1-yl)-3-pyridinyl]ethanone
CID 114055606
2-propan-2-yl-5-(2-propylpiperidin-1-yl)pyrimidine-4-carboxylic acid
CID 83044088

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid?
The IUPAC name of 3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid (CID 83061885) is 3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid.
What is the SMILES notation for 3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid?
The canonical SMILES for 3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid is CCCC1CCCCN1c1nccc(C(=O)O)c1N.
What is the InChIKey of 3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid?
The InChIKey is VINWLVLHUOTDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-2-5-10-6-3-4-9-17(10)13-12(15)11(14(18)19)7-8-16-13/h7-8,10H,2-6,9,15H2,1H3,(H,18,19).
What are the key properties of 3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid?
3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid has a molecular weight of 263.34 g/mol, XLogP of 2.52, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(2-propylpiperidin-1-yl)pyridine-4-carboxylic acid is sourced from PubChem (CID 83061885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).