2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid

C15H20N2O4 — CID 62689569

IUPAC2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid
SMILESO=C(O)CC1CCCN(C(=O)CCn2ccccc2=O)C1
InChIInChI=1S/C15H20N2O4/c18-13-5-1-2-7-16(13)9-6-14(19)17-8-3-4-12(11-17)10-15(20)21/h1-2,5,7,12H,3-4,6,8-11H2,(H,20,21)
InChIKeyOAQAYWZVHLWIKS-UHFFFAOYSA-N
MW292.33 g/mol
LogP0.95
Rot. Bonds5

About 2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid

2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid (PubChem CID 62689569) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is 2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid
PubChem CID62689569
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Name2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid
SMILESO=C(O)CC1CCCN(C(=O)CCn2ccccc2=O)C1
InChIInChI=1S/C15H20N2O4/c18-13-5-1-2-7-16(13)9-6-14(19)17-8-3-4-12(11-17)10-15(20)21/h1-2,5,7,12H,3-4,6,8-11H2,(H,20,21)
InChIKeyOAQAYWZVHLWIKS-UHFFFAOYSA-N
XLogP0.95
TPSA79.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[5-(4-Methylpiperidin-1-yl)-2-oxo-1-pyridinyl]butanoic acid
CID 39151151
1-[3-(2-Oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylic acid
CID 43170476
1-(1-Methyl-2-oxo-1,2-dihydropyridine-4-carbonyl)piperidine-4-carboxylic acid
CID 43354232
1-[3-(2-Oxopyridin-1-yl)propanoyl]piperidine-3-carboxylic acid
CID 43355898
Methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate
CID 43431194
3-[1-[(2E,4E)-hexa-2,4-dienoyl]piperidin-4-yl]propanoic acid
CID 55049223
1-[2-(2-Oxo-1-pyridinyl)acetyl]piperidine-4-carboxylic acid
CID 61320199
3-[1-(2-oxo-1H-pyridine-3-carbonyl)piperidin-4-yl]propanoic acid
CID 62216446
3-[1-(1-Methyl-2-oxopyridine-4-carbonyl)piperidin-4-yl]propanoic acid
CID 62218008
1-[3-[3-(2-Hydroxyethyl)piperidin-1-yl]-3-oxopropyl]pyridin-2-one
CID 62356251
2-[1-[2-(5-Bromo-2-oxo-1-pyridinyl)acetyl]piperidin-3-yl]acetic acid
CID 62689220
2-[1-(2-oxo-1H-pyridine-3-carbonyl)piperidin-3-yl]acetic acid
CID 62689724

Frequently Asked Questions

What is the IUPAC name of 2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid?
The IUPAC name of 2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid (CID 62689569) is 2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid.
What is the SMILES notation for 2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid?
The canonical SMILES for 2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid is O=C(O)CC1CCCN(C(=O)CCn2ccccc2=O)C1.
What is the InChIKey of 2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid?
The InChIKey is OAQAYWZVHLWIKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c18-13-5-1-2-7-16(13)9-6-14(19)17-8-3-4-12(11-17)10-15(20)21/h1-2,5,7,12H,3-4,6,8-11H2,(H,20,21).
What are the key properties of 2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid?
2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid has a molecular weight of 292.33 g/mol, XLogP of 0.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidin-3-yl]acetic acid is sourced from PubChem (CID 62689569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).