5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide

C9H14N4O3 — CID 102791400

IUPAC5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
SMILESCCNC(=O)c1noc(C2(N)CCOC2)n1
InChIInChI=1S/C9H14N4O3/c1-2-11-7(14)6-12-8(16-13-6)9(10)3-4-15-5-9/h2-5,10H2,1H3,(H,11,14)
InChIKeyHSVRVERJCUPCMP-UHFFFAOYSA-N
MW226.24 g/mol
LogP-0.61
Rot. Bonds3

About 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide

5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide (PubChem CID 102791400) has the molecular formula C9H14N4O3 and a molecular weight of 226.24 g/mol. Its IUPAC name is 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound Name5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
PubChem CID102791400
Molecular FormulaC9H14N4O3
Molecular Weight226.24 g/mol
Exact Mass226.11
IUPAC Name5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
SMILESCCNC(=O)c1noc(C2(N)CCOC2)n1
InChIInChI=1S/C9H14N4O3/c1-2-11-7(14)6-12-8(16-13-6)9(10)3-4-15-5-9/h2-5,10H2,1H3,(H,11,14)
InChIKeyHSVRVERJCUPCMP-UHFFFAOYSA-N
XLogP-0.61
TPSA103.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(1-aminocyclopentyl)methyl]-N-ethyl-1,2,4-oxadiazole-3-carboxamide
CID 102791146
3-[3-(methylsulfonylmethyl)-1,2,4-oxadiazol-5-yl]oxolan-3-amine
CID 64890771
3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)oxolan-3-amine
CID 64888058
5-(2-aminopropan-2-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
CID 102791094
3-[3-(1-ethoxycyclohexyl)-1,2,4-oxadiazol-5-yl]oxolan-3-amine
CID 116741976
5-(1-amino-1-cyclopropylethyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
CID 102791358
4-(3-ethyl-1,2,4-oxadiazol-5-yl)oxan-4-amine
CID 115292520
N-ethyl-5-[[1-(methylamino)cyclohexyl]methyl]-1,2,4-oxadiazole-3-carboxamide
CID 102791360
5-(2-amino-1-hydroxyethyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
CID 102791226
3-(3-cycloheptyl-1,2,4-oxadiazol-5-yl)oxolan-3-amine
CID 65390894
5-(1-amino-2,2-dimethylpropyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
CID 102791174
3-[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]oxolan-3-amine
CID 115532985

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide (CID 102791400) is 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide is CCNC(=O)c1noc(C2(N)CCOC2)n1.
What is the InChIKey of 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is HSVRVERJCUPCMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O3/c1-2-11-7(14)6-12-8(16-13-6)9(10)3-4-15-5-9/h2-5,10H2,1H3,(H,11,14).
What are the key properties of 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide?
5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 226.24 g/mol, XLogP of -0.61, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-aminooxolan-3-yl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 102791400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).