2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide

C10H16N4O2 — CID 106398114

IUPAC2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(C)NCc1noc(C)n1
InChIInChI=1S/C10H16N4O2/c1-4-5-11-10(15)7(2)12-6-9-13-8(3)16-14-9/h4,7,12H,1,5-6H2,2-3H3,(H,11,15)
InChIKeyWUZHHMMPRCWPBV-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.16
Rot. Bonds6

About 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide

2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide (PubChem CID 106398114) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide
PubChem CID106398114
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(C)NCc1noc(C)n1
InChIInChI=1S/C10H16N4O2/c1-4-5-11-10(15)7(2)12-6-9-13-8(3)16-14-9/h4,7,12H,1,5-6H2,2-3H3,(H,11,15)
InChIKeyWUZHHMMPRCWPBV-UHFFFAOYSA-N
XLogP0.16
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide 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 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide?
The IUPAC name of 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide (CID 106398114) is 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide.
What is the SMILES notation for 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide?
The canonical SMILES for 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide is C=CCNC(=O)C(C)NCc1noc(C)n1.
What is the InChIKey of 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide?
The InChIKey is WUZHHMMPRCWPBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-4-5-11-10(15)7(2)12-6-9-13-8(3)16-14-9/h4,7,12H,1,5-6H2,2-3H3,(H,11,15).
What are the key properties of 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide?
2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide has a molecular weight of 224.26 g/mol, XLogP of 0.16, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-N-prop-2-enylpropanamide is sourced from PubChem (CID 106398114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).