N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide

C5H7N3O3 — CID 130009396

IUPACN,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide
SMILESCNC(=O)n1nc(C)oc1=O
InChIInChI=1S/C5H7N3O3/c1-3-7-8(4(9)6-2)5(10)11-3/h1-2H3,(H,6,9)
InChIKeyHFFTTXVRZDLRAJ-UHFFFAOYSA-N
MW157.13 g/mol
LogP-0.67
Rot. Bonds

About N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide

N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide (PubChem CID 130009396) has the molecular formula C5H7N3O3 and a molecular weight of 157.13 g/mol. Its IUPAC name is N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide
PubChem CID130009396
Molecular FormulaC5H7N3O3
Molecular Weight157.13 g/mol
Exact Mass157.05
IUPAC NameN,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide
SMILESCNC(=O)n1nc(C)oc1=O
InChIInChI=1S/C5H7N3O3/c1-3-7-8(4(9)6-2)5(10)11-3/h1-2H3,(H,6,9)
InChIKeyHFFTTXVRZDLRAJ-UHFFFAOYSA-N
XLogP-0.67
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.13
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N,5-dimethyl-2-oxo-1,3,4-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

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide?
The IUPAC name of N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide (CID 130009396) is N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide.
What is the SMILES notation for N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide?
The canonical SMILES for N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide is CNC(=O)n1nc(C)oc1=O.
What is the InChIKey of N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide?
The InChIKey is HFFTTXVRZDLRAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O3/c1-3-7-8(4(9)6-2)5(10)11-3/h1-2H3,(H,6,9).
What are the key properties of N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide?
N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide has a molecular weight of 157.13 g/mol, XLogP of -0.67, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-2-oxo-1,3,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 130009396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).