N-(5-methyl-1,2-oxazol-4-yl)formamide

C5H6N2O2 — CID 13483363

IUPACN-(5-methyl-1,2-oxazol-4-yl)formamide
SMILESCc1oncc1NC=O
InChIInChI=1S/C5H6N2O2/c1-4-5(6-3-8)2-7-9-4/h2-3H,1H3,(H,6,8)
InChIKeyNQBMJJBDNIKCSY-UHFFFAOYSA-N
MW126.11 g/mol
LogP0.55
Rot. Bonds2

About N-(5-methyl-1,2-oxazol-4-yl)formamide

N-(5-methyl-1,2-oxazol-4-yl)formamide (PubChem CID 13483363) has the molecular formula C5H6N2O2 and a molecular weight of 126.11 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-4-yl)formamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-4-yl)formamide
PubChem CID13483363
Molecular FormulaC5H6N2O2
Molecular Weight126.11 g/mol
Exact Mass126.04
IUPAC NameN-(5-methyl-1,2-oxazol-4-yl)formamide
SMILESCc1oncc1NC=O
InChIInChI=1S/C5H6N2O2/c1-4-5(6-3-8)2-7-9-4/h2-3H,1H3,(H,6,8)
InChIKeyNQBMJJBDNIKCSY-UHFFFAOYSA-N
XLogP0.55
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.11
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze N-(5-methyl-1,2-oxazol-4-yl)formamide 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-methyl-1,2-oxazol-4-yl)formamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-4-yl)formamide (CID 13483363) is N-(5-methyl-1,2-oxazol-4-yl)formamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-4-yl)formamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-4-yl)formamide is Cc1oncc1NC=O.
What is the InChIKey of N-(5-methyl-1,2-oxazol-4-yl)formamide?
The InChIKey is NQBMJJBDNIKCSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O2/c1-4-5(6-3-8)2-7-9-4/h2-3H,1H3,(H,6,8).
What are the key properties of N-(5-methyl-1,2-oxazol-4-yl)formamide?
N-(5-methyl-1,2-oxazol-4-yl)formamide has a molecular weight of 126.11 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-4-yl)formamide is sourced from PubChem (CID 13483363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).