N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide

C11H17N3O2 — CID 38764993

IUPACN-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide
SMILESCC(C)c1noc(CCC(=O)NC2CC2)n1
InChIInChI=1S/C11H17N3O2/c1-7(2)11-13-10(16-14-11)6-5-9(15)12-8-3-4-8/h7-8H,3-6H2,1-2H3,(H,12,15)
InChIKeyNCNLABYFDWQXBI-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.40
Rot. Bonds5

About N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide

N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide (PubChem CID 38764993) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide
PubChem CID38764993
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC NameN-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide
SMILESCC(C)c1noc(CCC(=O)NC2CC2)n1
InChIInChI=1S/C11H17N3O2/c1-7(2)11-13-10(16-14-11)6-5-9(15)12-8-3-4-8/h7-8H,3-6H2,1-2H3,(H,12,15)
InChIKeyNCNLABYFDWQXBI-UHFFFAOYSA-N
XLogP1.40
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide 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 N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide?
The IUPAC name of N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide (CID 38764993) is N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide.
What is the SMILES notation for N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide?
The canonical SMILES for N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide is CC(C)c1noc(CCC(=O)NC2CC2)n1.
What is the InChIKey of N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide?
The InChIKey is NCNLABYFDWQXBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-7(2)11-13-10(16-14-11)6-5-9(15)12-8-3-4-8/h7-8H,3-6H2,1-2H3,(H,12,15).
What are the key properties of N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide?
N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide has a molecular weight of 223.28 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide is sourced from PubChem (CID 38764993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).