3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide

C9H12N2O2 — CID 126997862

IUPAC3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide
SMILESO=C(CCC1CC1)Nc1cnoc1
InChIInChI=1S/C9H12N2O2/c12-9(4-3-7-1-2-7)11-8-5-10-13-6-8/h5-7H,1-4H2,(H,11,12)
InChIKeyHESSGOGXSAIDMA-UHFFFAOYSA-N
MW180.21 g/mol
LogP1.80
Rot. Bonds4

About 3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide

3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide (PubChem CID 126997862) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is 3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide.

Molecular Properties

Compound Name3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide
PubChem CID126997862
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide
SMILESO=C(CCC1CC1)Nc1cnoc1
InChIInChI=1S/C9H12N2O2/c12-9(4-3-7-1-2-7)11-8-5-10-13-6-8/h5-7H,1-4H2,(H,11,12)
InChIKeyHESSGOGXSAIDMA-UHFFFAOYSA-N
XLogP1.80
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide?
The IUPAC name of 3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide (CID 126997862) is 3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide.
What is the SMILES notation for 3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide?
The canonical SMILES for 3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide is O=C(CCC1CC1)Nc1cnoc1.
What is the InChIKey of 3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide?
The InChIKey is HESSGOGXSAIDMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c12-9(4-3-7-1-2-7)11-8-5-10-13-6-8/h5-7H,1-4H2,(H,11,12).
What are the key properties of 3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide?
3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide has a molecular weight of 180.21 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-(1,2-oxazol-4-yl)propanamide is sourced from PubChem (CID 126997862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).