4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid

C12H16N2O4 — CID 23133594

IUPAC4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid
SMILESCOc1ccc(OC2CCN(C(=O)O)CC2)nc1
InChIInChI=1S/C12H16N2O4/c1-17-10-2-3-11(13-8-10)18-9-4-6-14(7-5-9)12(15)16/h2-3,8-9H,4-7H2,1H3,(H,15,16)
InChIKeyOIUZWTLZUAITTF-UHFFFAOYSA-N
MW252.27 g/mol
LogP1.61
Rot. Bonds3

About 4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid

4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid (PubChem CID 23133594) has the molecular formula C12H16N2O4 and a molecular weight of 252.27 g/mol. Its IUPAC name is 4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid
PubChem CID23133594
Molecular FormulaC12H16N2O4
Molecular Weight252.27 g/mol
Exact Mass252.11
IUPAC Name4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid
SMILESCOc1ccc(OC2CCN(C(=O)O)CC2)nc1
InChIInChI=1S/C12H16N2O4/c1-17-10-2-3-11(13-8-10)18-9-4-6-14(7-5-9)12(15)16/h2-3,8-9H,4-7H2,1H3,(H,15,16)
InChIKeyOIUZWTLZUAITTF-UHFFFAOYSA-N
XLogP1.61
TPSA71.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid?
The IUPAC name of 4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid (CID 23133594) is 4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid.
What is the SMILES notation for 4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid?
The canonical SMILES for 4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid is COc1ccc(OC2CCN(C(=O)O)CC2)nc1.
What is the InChIKey of 4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid?
The InChIKey is OIUZWTLZUAITTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O4/c1-17-10-2-3-11(13-8-10)18-9-4-6-14(7-5-9)12(15)16/h2-3,8-9H,4-7H2,1H3,(H,15,16).
What are the key properties of 4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid?
4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid has a molecular weight of 252.27 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-methoxy-2-pyridinyl)oxy]piperidine-1-carboxylic acid is sourced from PubChem (CID 23133594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).