2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide

C11H13N5O3 — CID 131963749

IUPAC2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide
SMILESCCn1nccc1C(=O)NCc1nc(C(N)=O)co1
InChIInChI=1S/C11H13N5O3/c1-2-16-8(3-4-14-16)11(18)13-5-9-15-7(6-19-9)10(12)17/h3-4,6H,2,5H2,1H3,(H2,12,17)(H,13,18)
InChIKeyJHDBZOWOEHKFBY-UHFFFAOYSA-N
MW263.26 g/mol
LogP-0.08
Rot. Bonds5

About 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide

2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide (PubChem CID 131963749) has the molecular formula C11H13N5O3 and a molecular weight of 263.26 g/mol. Its IUPAC name is 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide
PubChem CID131963749
Molecular FormulaC11H13N5O3
Molecular Weight263.26 g/mol
Exact Mass263.10
IUPAC Name2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide
SMILESCCn1nccc1C(=O)NCc1nc(C(N)=O)co1
InChIInChI=1S/C11H13N5O3/c1-2-16-8(3-4-14-16)11(18)13-5-9-15-7(6-19-9)10(12)17/h3-4,6H,2,5H2,1H3,(H2,12,17)(H,13,18)
InChIKeyJHDBZOWOEHKFBY-UHFFFAOYSA-N
XLogP-0.08
TPSA116.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.26
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-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 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide (CID 131963749) is 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide is CCn1nccc1C(=O)NCc1nc(C(N)=O)co1.
What is the InChIKey of 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide?
The InChIKey is JHDBZOWOEHKFBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O3/c1-2-16-8(3-4-14-16)11(18)13-5-9-15-7(6-19-9)10(12)17/h3-4,6H,2,5H2,1H3,(H2,12,17)(H,13,18).
What are the key properties of 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide?
2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide has a molecular weight of 263.26 g/mol, XLogP of -0.08, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2-ethylpyrazole-3-carbonyl)amino]methyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 131963749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).