N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide

C10H13N5O2S — CID 17424534

IUPACN-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
SMILESCCc1nnc(NC(=O)C2=NN(C)C(=O)CC2)s1
InChIInChI=1S/C10H13N5O2S/c1-3-7-12-13-10(18-7)11-9(17)6-4-5-8(16)15(2)14-6/h3-5H2,1-2H3,(H,11,13,17)
InChIKeyLMBKGXFKOHVDIL-UHFFFAOYSA-N
MW267.31 g/mol
LogP0.65
Rot. Bonds3

About N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide

N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide (PubChem CID 17424534) has the molecular formula C10H13N5O2S and a molecular weight of 267.31 g/mol. Its IUPAC name is N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
PubChem CID17424534
Molecular FormulaC10H13N5O2S
Molecular Weight267.31 g/mol
Exact Mass267.08
IUPAC NameN-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
SMILESCCc1nnc(NC(=O)C2=NN(C)C(=O)CC2)s1
InChIInChI=1S/C10H13N5O2S/c1-3-7-12-13-10(18-7)11-9(17)6-4-5-8(16)15(2)14-6/h3-5H2,1-2H3,(H,11,13,17)
InChIKeyLMBKGXFKOHVDIL-UHFFFAOYSA-N
XLogP0.65
TPSA87.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-6-oxo-N-propyl-4,5-dihydropyridazine-3-carboxamide
CID 47014189
1-methyl-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 78826199
1-methyl-6-oxo-N-pentyl-4,5-dihydropyridazine-3-carboxamide
CID 30384665
1-(2,5-dimethylphenyl)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 30258041
N-[5-[(3,5-difluorophenyl)methyl]-1,3-thiazol-2-yl]-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 139521766
N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 24599284
1-butyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-6-oxopyridazine-3-carboxamide
CID 18081137
N-[5-[(4-cyanophenyl)methyl]-1,3-thiazol-2-yl]-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 155153155
3-[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]propanoic acid
CID 43170671
1-[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]cyclopropane-1-carboxylic acid
CID 65450800
2-[4-[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]phenyl]acetic acid
CID 43358512
2-methyl-2-[(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]butanoic acid
CID 79793544

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The IUPAC name of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide (CID 17424534) is N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide.
What is the SMILES notation for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The canonical SMILES for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide is CCc1nnc(NC(=O)C2=NN(C)C(=O)CC2)s1.
What is the InChIKey of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The InChIKey is LMBKGXFKOHVDIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2S/c1-3-7-12-13-10(18-7)11-9(17)6-4-5-8(16)15(2)14-6/h3-5H2,1-2H3,(H,11,13,17).
What are the key properties of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide has a molecular weight of 267.31 g/mol, XLogP of 0.65, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide is sourced from PubChem (CID 17424534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).