2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide

C16H18N4O3S — CID 71840121

IUPAC2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide
SMILESCCc1nc2c(=O)n(CC(=O)NCc3ccc(C)o3)nc(C)c2s1
InChIInChI=1S/C16H18N4O3S/c1-4-13-18-14-15(24-13)10(3)19-20(16(14)22)8-12(21)17-7-11-6-5-9(2)23-11/h5-6H,4,7-8H2,1-3H3,(H,17,21)
InChIKeyNFENEUNMBZNAQB-UHFFFAOYSA-N
MW346.41 g/mol
LogP1.94
Rot. Bonds5

About 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide

2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide (PubChem CID 71840121) has the molecular formula C16H18N4O3S and a molecular weight of 346.41 g/mol. Its IUPAC name is 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide
PubChem CID71840121
Molecular FormulaC16H18N4O3S
Molecular Weight346.41 g/mol
Exact Mass346.11
IUPAC Name2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide
SMILESCCc1nc2c(=O)n(CC(=O)NCc3ccc(C)o3)nc(C)c2s1
InChIInChI=1S/C16H18N4O3S/c1-4-13-18-14-15(24-13)10(3)19-20(16(14)22)8-12(21)17-7-11-6-5-9(2)23-11/h5-6H,4,7-8H2,1-3H3,(H,17,21)
InChIKeyNFENEUNMBZNAQB-UHFFFAOYSA-N
XLogP1.94
TPSA90.02 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(4-propan-2-ylphenyl)methyl]acetamide
CID 71840103
N-[(5-methylfuran-2-yl)methyl]-2-(9-oxo-12-propyl-3-thia-1,10,11-triazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,11-tetraen-10-yl)acetamide
CID 16670885
N-[(4-fluorophenyl)methyl]-2-(7-methyl-4-oxo-2-phenyl-[1,3]thiazolo[4,5-d]pyridazin-5-yl)acetamide
CID 71840042
2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-pyrrol-1-ylpyrazolo[3,4-d]pyridazin-5-yl]-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 22575381
2-ethyl-7-methyl-5-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-[1,3]thiazolo[4,5-d]pyridazin-4-one
CID 71840117
5-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-2-ethyl-7-methyl-[1,3]thiazolo[4,5-d]pyridazin-4-one
CID 71840164
2-[2-(4-ethylpiperazin-1-yl)-7-oxo-[1,3]thiazolo[4,5-d]pyrimidin-6-yl]-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 50927787
N-(3-methoxypropyl)-2-(7-methyl-4-oxo-2-phenyl-[1,3]thiazolo[4,5-d]pyridazin-5-yl)acetamide
CID 71840046
2-(3-aminopyrazol-1-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 62522791
3-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide
CID 110731621
N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]-2-(4-methyl-1-oxophthalazin-2-yl)acetamide
CID 56747492
N-benzyl-2-(2-methyl-4-oxo-7-phenyl-[1,3]thiazolo[4,5-d]pyridazin-5-yl)acetamide
CID 16905876

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide?
The IUPAC name of 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide (CID 71840121) is 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide.
What is the SMILES notation for 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide?
The canonical SMILES for 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide is CCc1nc2c(=O)n(CC(=O)NCc3ccc(C)o3)nc(C)c2s1.
What is the InChIKey of 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide?
The InChIKey is NFENEUNMBZNAQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3S/c1-4-13-18-14-15(24-13)10(3)19-20(16(14)22)8-12(21)17-7-11-6-5-9(2)23-11/h5-6H,4,7-8H2,1-3H3,(H,17,21).
What are the key properties of 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide?
2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide has a molecular weight of 346.41 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-7-methyl-4-oxo-[1,3]thiazolo[4,5-d]pyridazin-5-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide is sourced from PubChem (CID 71840121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).