1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide

C13H14N4O3S — CID 71785278

IUPAC1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide
SMILESCc1cc(C(=O)N2CC(C(=O)Nc3ncc(C)s3)C2)no1
InChIInChI=1S/C13H14N4O3S/c1-7-3-10(16-20-7)12(19)17-5-9(6-17)11(18)15-13-14-4-8(2)21-13/h3-4,9H,5-6H2,1-2H3,(H,14,15,18)
InChIKeyQFGMMNGPTDAYTQ-UHFFFAOYSA-N
MW306.35 g/mol
LogP1.46
Rot. Bonds3

About 1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide

1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide (PubChem CID 71785278) has the molecular formula C13H14N4O3S and a molecular weight of 306.35 g/mol. Its IUPAC name is 1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide.

Molecular Properties

Compound Name1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide
PubChem CID71785278
Molecular FormulaC13H14N4O3S
Molecular Weight306.35 g/mol
Exact Mass306.08
IUPAC Name1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide
SMILESCc1cc(C(=O)N2CC(C(=O)Nc3ncc(C)s3)C2)no1
InChIInChI=1S/C13H14N4O3S/c1-7-3-10(16-20-7)12(19)17-5-9(6-17)11(18)15-13-14-4-8(2)21-13/h3-4,9H,5-6H2,1-2H3,(H,14,15,18)
InChIKeyQFGMMNGPTDAYTQ-UHFFFAOYSA-N
XLogP1.46
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.35
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide?
The IUPAC name of 1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide (CID 71785278) is 1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide.
What is the SMILES notation for 1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide?
The canonical SMILES for 1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide is Cc1cc(C(=O)N2CC(C(=O)Nc3ncc(C)s3)C2)no1.
What is the InChIKey of 1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide?
The InChIKey is QFGMMNGPTDAYTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O3S/c1-7-3-10(16-20-7)12(19)17-5-9(6-17)11(18)15-13-14-4-8(2)21-13/h3-4,9H,5-6H2,1-2H3,(H,14,15,18).
What are the key properties of 1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide?
1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide has a molecular weight of 306.35 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1,2-oxazole-3-carbonyl)-N-(5-methyl-1,3-thiazol-2-yl)azetidine-3-carboxamide is sourced from PubChem (CID 71785278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).