4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide

C15H18N4O4S — CID 25444482

IUPAC4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide
SMILESCc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)o1
InChIInChI=1S/C15H18N4O4S/c1-9-3-4-11(23-9)13(20)17-18-14(21)12-10(2)16-15(24-12)19-5-7-22-8-6-19/h3-4H,5-8H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyARCIYUXSECHUGA-UHFFFAOYSA-N
MW350.40 g/mol
LogP1.26
Rot. Bonds3

About 4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide

4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide (PubChem CID 25444482) has the molecular formula C15H18N4O4S and a molecular weight of 350.40 g/mol. Its IUPAC name is 4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide.

Molecular Properties

Compound Name4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide
PubChem CID25444482
Molecular FormulaC15H18N4O4S
Molecular Weight350.40 g/mol
Exact Mass350.10
IUPAC Name4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide
SMILESCc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)o1
InChIInChI=1S/C15H18N4O4S/c1-9-3-4-11(23-9)13(20)17-18-14(21)12-10(2)16-15(24-12)19-5-7-22-8-6-19/h3-4H,5-8H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyARCIYUXSECHUGA-UHFFFAOYSA-N
XLogP1.26
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide?
The IUPAC name of 4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide (CID 25444482) is 4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide.
What is the SMILES notation for 4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide?
The canonical SMILES for 4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide is Cc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)o1.
What is the InChIKey of 4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide?
The InChIKey is ARCIYUXSECHUGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O4S/c1-9-3-4-11(23-9)13(20)17-18-14(21)12-10(2)16-15(24-12)19-5-7-22-8-6-19/h3-4H,5-8H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of 4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide?
4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide has a molecular weight of 350.40 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N'-(5-methylfuran-2-carbonyl)-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide is sourced from PubChem (CID 25444482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).