3-methyl-N-(2-oxooxolan-3-yl)pentanamide

C10H17NO3 — CID 59157424

IUPAC3-methyl-N-(2-oxooxolan-3-yl)pentanamide
SMILESCCC(C)CC(=O)NC1CCOC1=O
InChIInChI=1S/C10H17NO3/c1-3-7(2)6-9(12)11-8-4-5-14-10(8)13/h7-8H,3-6H2,1-2H3,(H,11,12)
InChIKeyWPBHFWLAVZWMKV-UHFFFAOYSA-N
MW199.25 g/mol
LogP0.85
Rot. Bonds4

About 3-methyl-N-(2-oxooxolan-3-yl)pentanamide

3-methyl-N-(2-oxooxolan-3-yl)pentanamide (PubChem CID 59157424) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is 3-methyl-N-(2-oxooxolan-3-yl)pentanamide.

Molecular Properties

Compound Name3-methyl-N-(2-oxooxolan-3-yl)pentanamide
PubChem CID59157424
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name3-methyl-N-(2-oxooxolan-3-yl)pentanamide
SMILESCCC(C)CC(=O)NC1CCOC1=O
InChIInChI=1S/C10H17NO3/c1-3-7(2)6-9(12)11-8-4-5-14-10(8)13/h7-8H,3-6H2,1-2H3,(H,11,12)
InChIKeyWPBHFWLAVZWMKV-UHFFFAOYSA-N
XLogP0.85
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-oxooxolan-3-yl)pentanamide?
The IUPAC name of 3-methyl-N-(2-oxooxolan-3-yl)pentanamide (CID 59157424) is 3-methyl-N-(2-oxooxolan-3-yl)pentanamide.
What is the SMILES notation for 3-methyl-N-(2-oxooxolan-3-yl)pentanamide?
The canonical SMILES for 3-methyl-N-(2-oxooxolan-3-yl)pentanamide is CCC(C)CC(=O)NC1CCOC1=O.
What is the InChIKey of 3-methyl-N-(2-oxooxolan-3-yl)pentanamide?
The InChIKey is WPBHFWLAVZWMKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c1-3-7(2)6-9(12)11-8-4-5-14-10(8)13/h7-8H,3-6H2,1-2H3,(H,11,12).
What are the key properties of 3-methyl-N-(2-oxooxolan-3-yl)pentanamide?
3-methyl-N-(2-oxooxolan-3-yl)pentanamide has a molecular weight of 199.25 g/mol, XLogP of 0.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-oxooxolan-3-yl)pentanamide is sourced from PubChem (CID 59157424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).