4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid

C10H16O4 — CID 58663282

IUPAC4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid
SMILESCC(CCC(=O)O)CC1CCC(=O)O1
InChIInChI=1S/C10H16O4/c1-7(2-4-9(11)12)6-8-3-5-10(13)14-8/h7-8H,2-6H2,1H3,(H,11,12)
InChIKeyFVRIXBCKDAMQGO-UHFFFAOYSA-N
MW200.23 g/mol
LogP1.58
Rot. Bonds5

About 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid

4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid (PubChem CID 58663282) has the molecular formula C10H16O4 and a molecular weight of 200.23 g/mol. Its IUPAC name is 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid.

Molecular Properties

Compound Name4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid
PubChem CID58663282
Molecular FormulaC10H16O4
Molecular Weight200.23 g/mol
Exact Mass200.10
IUPAC Name4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid
SMILESCC(CCC(=O)O)CC1CCC(=O)O1
InChIInChI=1S/C10H16O4/c1-7(2-4-9(11)12)6-8-3-5-10(13)14-8/h7-8H,2-6H2,1H3,(H,11,12)
InChIKeyFVRIXBCKDAMQGO-UHFFFAOYSA-N
XLogP1.58
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.23
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid?
The IUPAC name of 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid (CID 58663282) is 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid.
What is the SMILES notation for 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid?
The canonical SMILES for 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid is CC(CCC(=O)O)CC1CCC(=O)O1.
What is the InChIKey of 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid?
The InChIKey is FVRIXBCKDAMQGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O4/c1-7(2-4-9(11)12)6-8-3-5-10(13)14-8/h7-8H,2-6H2,1H3,(H,11,12).
What are the key properties of 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid?
4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid has a molecular weight of 200.23 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(5-oxooxolan-2-yl)pentanoic acid is sourced from PubChem (CID 58663282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).