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

C7H11NO3 — CID 21476807

IUPACN-(2-oxooxolan-3-yl)propanamide
SMILESCCC(=O)NC1CCOC1=O
InChIInChI=1S/C7H11NO3/c1-2-6(9)8-5-3-4-11-7(5)10/h5H,2-4H2,1H3,(H,8,9)
InChIKeyBHUQNXLFFUYMDZ-UHFFFAOYSA-N
MW157.17 g/mol
LogP-0.17
Rot. Bonds2

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

N-(2-oxooxolan-3-yl)propanamide (PubChem CID 21476807) has the molecular formula C7H11NO3 and a molecular weight of 157.17 g/mol. Its IUPAC name is N-(2-oxooxolan-3-yl)propanamide.

Molecular Properties

Compound NameN-(2-oxooxolan-3-yl)propanamide
PubChem CID21476807
Molecular FormulaC7H11NO3
Molecular Weight157.17 g/mol
Exact Mass157.07
IUPAC NameN-(2-oxooxolan-3-yl)propanamide
SMILESCCC(=O)NC1CCOC1=O
InChIInChI=1S/C7H11NO3/c1-2-6(9)8-5-3-4-11-7(5)10/h5H,2-4H2,1H3,(H,8,9)
InChIKeyBHUQNXLFFUYMDZ-UHFFFAOYSA-N
XLogP-0.17
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.17
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-oxooxolan-3-yl)propanamide?
The IUPAC name of N-(2-oxooxolan-3-yl)propanamide (CID 21476807) is N-(2-oxooxolan-3-yl)propanamide.
What is the SMILES notation for N-(2-oxooxolan-3-yl)propanamide?
The canonical SMILES for N-(2-oxooxolan-3-yl)propanamide is CCC(=O)NC1CCOC1=O.
What is the InChIKey of N-(2-oxooxolan-3-yl)propanamide?
The InChIKey is BHUQNXLFFUYMDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO3/c1-2-6(9)8-5-3-4-11-7(5)10/h5H,2-4H2,1H3,(H,8,9).
What are the key properties of N-(2-oxooxolan-3-yl)propanamide?
N-(2-oxooxolan-3-yl)propanamide has a molecular weight of 157.17 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxooxolan-3-yl)propanamide is sourced from PubChem (CID 21476807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).