2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid

C14H20N2O3 — CID 82896577

IUPAC2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid
SMILESO=C(O)CC1CCCCN1CCn1ccccc1=O
InChIInChI=1S/C14H20N2O3/c17-13-6-2-4-8-16(13)10-9-15-7-3-1-5-12(15)11-14(18)19/h2,4,6,8,12H,1,3,5,7,9-11H2,(H,18,19)
InChIKeyHFDYFLSPQBBRLW-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.18
Rot. Bonds5

About 2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid

2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid (PubChem CID 82896577) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid
PubChem CID82896577
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid
SMILESO=C(O)CC1CCCCN1CCn1ccccc1=O
InChIInChI=1S/C14H20N2O3/c17-13-6-2-4-8-16(13)10-9-15-7-3-1-5-12(15)11-14(18)19/h2,4,6,8,12H,1,3,5,7,9-11H2,(H,18,19)
InChIKeyHFDYFLSPQBBRLW-UHFFFAOYSA-N
XLogP1.18
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid?
The IUPAC name of 2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid (CID 82896577) is 2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid.
What is the SMILES notation for 2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid?
The canonical SMILES for 2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid is O=C(O)CC1CCCCN1CCn1ccccc1=O.
What is the InChIKey of 2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid?
The InChIKey is HFDYFLSPQBBRLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c17-13-6-2-4-8-16(13)10-9-15-7-3-1-5-12(15)11-14(18)19/h2,4,6,8,12H,1,3,5,7,9-11H2,(H,18,19).
What are the key properties of 2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid?
2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid has a molecular weight of 264.32 g/mol, XLogP of 1.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-oxo-1-pyridinyl)ethyl]piperidin-2-yl]acetic acid is sourced from PubChem (CID 82896577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).