N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide

C9H15N3O2 — CID 83617699

IUPACN-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide
SMILESCCc1oncc1C(=O)NCC(C)N
InChIInChI=1S/C9H15N3O2/c1-3-8-7(5-12-14-8)9(13)11-4-6(2)10/h5-6H,3-4,10H2,1-2H3,(H,11,13)
InChIKeyPGIYTRWKRYNBKP-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.31
Rot. Bonds4

About N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide

N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide (PubChem CID 83617699) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide
PubChem CID83617699
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC NameN-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide
SMILESCCc1oncc1C(=O)NCC(C)N
InChIInChI=1S/C9H15N3O2/c1-3-8-7(5-12-14-8)9(13)11-4-6(2)10/h5-6H,3-4,10H2,1-2H3,(H,11,13)
InChIKeyPGIYTRWKRYNBKP-UHFFFAOYSA-N
XLogP0.31
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide 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-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide (CID 83617699) is N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide is CCc1oncc1C(=O)NCC(C)N.
What is the InChIKey of N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide?
The InChIKey is PGIYTRWKRYNBKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-3-8-7(5-12-14-8)9(13)11-4-6(2)10/h5-6H,3-4,10H2,1-2H3,(H,11,13).
What are the key properties of N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide?
N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide has a molecular weight of 197.24 g/mol, XLogP of 0.31, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminopropyl)-5-ethyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 83617699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).