N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide

C7H6N4O2 — CID 130735034

IUPACN-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide
SMILESO=C(Nc1ncc[nH]1)c1cocn1
InChIInChI=1S/C7H6N4O2/c12-6(5-3-13-4-10-5)11-7-8-1-2-9-7/h1-4H,(H2,8,9,11,12)
InChIKeyMHRLCMOBGUMPBB-UHFFFAOYSA-N
MW178.15 g/mol
LogP0.65
Rot. Bonds2

About N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide

N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide (PubChem CID 130735034) has the molecular formula C7H6N4O2 and a molecular weight of 178.15 g/mol. Its IUPAC name is N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide
PubChem CID130735034
Molecular FormulaC7H6N4O2
Molecular Weight178.15 g/mol
Exact Mass178.05
IUPAC NameN-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide
SMILESO=C(Nc1ncc[nH]1)c1cocn1
InChIInChI=1S/C7H6N4O2/c12-6(5-3-13-4-10-5)11-7-8-1-2-9-7/h1-4H,(H2,8,9,11,12)
InChIKeyMHRLCMOBGUMPBB-UHFFFAOYSA-N
XLogP0.65
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.15
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1H-imidazol-2-yl)-1,3-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-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide (CID 130735034) is N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide is O=C(Nc1ncc[nH]1)c1cocn1.
What is the InChIKey of N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide?
The InChIKey is MHRLCMOBGUMPBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N4O2/c12-6(5-3-13-4-10-5)11-7-8-1-2-9-7/h1-4H,(H2,8,9,11,12).
What are the key properties of N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide?
N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide has a molecular weight of 178.15 g/mol, XLogP of 0.65, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-yl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 130735034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).