2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid

C15H20N2O4 — CID 64671816

IUPAC2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid
SMILESO=C(O)CC1(NC(=O)CCn2ccccc2=O)CCCC1
InChIInChI=1S/C15H20N2O4/c18-12(6-10-17-9-4-1-5-13(17)19)16-15(11-14(20)21)7-2-3-8-15/h1,4-5,9H,2-3,6-8,10-11H2,(H,16,18)(H,20,21)
InChIKeyGCUPHZZHQYSQID-UHFFFAOYSA-N
MW292.33 g/mol
LogP1.14
Rot. Bonds6

About 2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid

2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid (PubChem CID 64671816) 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)propanoylamino]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid
PubChem CID64671816
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Name2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid
SMILESO=C(O)CC1(NC(=O)CCn2ccccc2=O)CCCC1
InChIInChI=1S/C15H20N2O4/c18-12(6-10-17-9-4-1-5-13(17)19)16-15(11-14(20)21)7-2-3-8-15/h1,4-5,9H,2-3,6-8,10-11H2,(H,16,18)(H,20,21)
InChIKeyGCUPHZZHQYSQID-UHFFFAOYSA-N
XLogP1.14
TPSA88.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid (CID 64671816) is 2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid is O=C(O)CC1(NC(=O)CCn2ccccc2=O)CCCC1.
What is the InChIKey of 2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid?
The InChIKey is GCUPHZZHQYSQID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c18-12(6-10-17-9-4-1-5-13(17)19)16-15(11-14(20)21)7-2-3-8-15/h1,4-5,9H,2-3,6-8,10-11H2,(H,16,18)(H,20,21).
What are the key properties of 2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid?
2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid has a molecular weight of 292.33 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[3-(2-oxo-1-pyridinyl)propanoylamino]cyclopentyl]acetic acid is sourced from PubChem (CID 64671816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).