2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide

C9H15NO3 — CID 23020660

IUPAC2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide
SMILESCC(C)(C)C(=O)NC1CCOC1=O
InChIInChI=1S/C9H15NO3/c1-9(2,3)8(12)10-6-4-5-13-7(6)11/h6H,4-5H2,1-3H3,(H,10,12)
InChIKeyHUHRDQYYOYTLTM-UHFFFAOYSA-N
MW185.22 g/mol
LogP0.46
Rot. Bonds1

About 2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide

2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide (PubChem CID 23020660) has the molecular formula C9H15NO3 and a molecular weight of 185.22 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide
PubChem CID23020660
Molecular FormulaC9H15NO3
Molecular Weight185.22 g/mol
Exact Mass185.11
IUPAC Name2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide
SMILESCC(C)(C)C(=O)NC1CCOC1=O
InChIInChI=1S/C9H15NO3/c1-9(2,3)8(12)10-6-4-5-13-7(6)11/h6H,4-5H2,1-3H3,(H,10,12)
InChIKeyHUHRDQYYOYTLTM-UHFFFAOYSA-N
XLogP0.46
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.22
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide (CID 23020660) is 2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide is CC(C)(C)C(=O)NC1CCOC1=O.
What is the InChIKey of 2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide?
The InChIKey is HUHRDQYYOYTLTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO3/c1-9(2,3)8(12)10-6-4-5-13-7(6)11/h6H,4-5H2,1-3H3,(H,10,12).
What are the key properties of 2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide?
2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide has a molecular weight of 185.22 g/mol, XLogP of 0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2-oxooxolan-3-yl)propanamide is sourced from PubChem (CID 23020660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).