4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid

C11H15N3O2 — CID 69115418

IUPAC4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid
SMILESNc1cncc(C2CCN(C(=O)O)CC2)c1
InChIInChI=1S/C11H15N3O2/c12-10-5-9(6-13-7-10)8-1-3-14(4-2-8)11(15)16/h5-8H,1-4,12H2,(H,15,16)
InChIKeyIOENPIFKRPRXAE-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.52
Rot. Bonds1

About 4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid

4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid (PubChem CID 69115418) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid
PubChem CID69115418
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid
SMILESNc1cncc(C2CCN(C(=O)O)CC2)c1
InChIInChI=1S/C11H15N3O2/c12-10-5-9(6-13-7-10)8-1-3-14(4-2-8)11(15)16/h5-8H,1-4,12H2,(H,15,16)
InChIKeyIOENPIFKRPRXAE-UHFFFAOYSA-N
XLogP1.52
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid?
The IUPAC name of 4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid (CID 69115418) is 4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid.
What is the SMILES notation for 4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid?
The canonical SMILES for 4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid is Nc1cncc(C2CCN(C(=O)O)CC2)c1.
What is the InChIKey of 4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid?
The InChIKey is IOENPIFKRPRXAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c12-10-5-9(6-13-7-10)8-1-3-14(4-2-8)11(15)16/h5-8H,1-4,12H2,(H,15,16).
What are the key properties of 4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid?
4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid has a molecular weight of 221.26 g/mol, XLogP of 1.52, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-amino-3-pyridinyl)piperidine-1-carboxylic acid is sourced from PubChem (CID 69115418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).