5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid

C11H15N3O2 — CID 115760472

IUPAC5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid
SMILESNC1CCN(c2ccc(C(=O)O)nc2)CC1
InChIInChI=1S/C11H15N3O2/c12-8-3-5-14(6-4-8)9-1-2-10(11(15)16)13-7-9/h1-2,7-8H,3-6,12H2,(H,15,16)
InChIKeyASQMHQLTDOEZIH-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.71
Rot. Bonds2

About 5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid

5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid (PubChem CID 115760472) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid
PubChem CID115760472
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid
SMILESNC1CCN(c2ccc(C(=O)O)nc2)CC1
InChIInChI=1S/C11H15N3O2/c12-8-3-5-14(6-4-8)9-1-2-10(11(15)16)13-7-9/h1-2,7-8H,3-6,12H2,(H,15,16)
InChIKeyASQMHQLTDOEZIH-UHFFFAOYSA-N
XLogP0.71
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-ethylazepan-1-yl)pyridine-2-carboxylic acid
CID 113321639
5-[3-(2-hydroxyethyl)pyrrolidin-1-yl]pyridine-2-carboxylic acid
CID 114797982
5-[3-(1-hydroxyethyl)pyrrolidin-1-yl]pyridine-2-carboxylic acid
CID 104638980
4-(4-aminopiperidin-1-yl)benzoic acid
CID 18617654
6-(4-aminopiperidin-1-yl)pyridazine-3-carboxylic acid
CID 61402767
5-(4-formylpiperidin-1-yl)pyridine-2-carboxamide
CID 171070571
5-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carboxylic acid
CID 115490992
5-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)pyridine-2-carboxylic acid
CID 115491013
N-[[1-(6-acetyl-3-pyridinyl)piperidin-4-yl]methyl]acetamide
CID 102736440
1-[5-(4-methoxypiperidin-1-yl)-2-pyridinyl]ethanone
CID 83118736
1-[5-(4-propylazepan-1-yl)-2-pyridinyl]ethanone
CID 83118890
5-[4-(4-methylbenzoyl)piperazin-1-yl]pyridine-2-carboxylic acid
CID 83971695

Frequently Asked Questions

What is the IUPAC name of 5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid?
The IUPAC name of 5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid (CID 115760472) is 5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid is NC1CCN(c2ccc(C(=O)O)nc2)CC1.
What is the InChIKey of 5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid?
The InChIKey is ASQMHQLTDOEZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c12-8-3-5-14(6-4-8)9-1-2-10(11(15)16)13-7-9/h1-2,7-8H,3-6,12H2,(H,15,16).
What are the key properties of 5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid?
5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid has a molecular weight of 221.26 g/mol, XLogP of 0.71, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-aminopiperidin-1-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 115760472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).