6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide

C10H9ClN4OS — CID 61282849

IUPAC6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide
SMILESCc1ncc(CNC(=O)c2ccc(Cl)nn2)s1
InChIInChI=1S/C10H9ClN4OS/c1-6-12-4-7(17-6)5-13-10(16)8-2-3-9(11)15-14-8/h2-4H,5H2,1H3,(H,13,16)
InChIKeyNZDLPDXGMAFJSW-UHFFFAOYSA-N
MW268.73 g/mol
LogP1.82
Rot. Bonds3

About 6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide

6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide (PubChem CID 61282849) has the molecular formula C10H9ClN4OS and a molecular weight of 268.73 g/mol. Its IUPAC name is 6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide
PubChem CID61282849
Molecular FormulaC10H9ClN4OS
Molecular Weight268.73 g/mol
Exact Mass268.02
IUPAC Name6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide
SMILESCc1ncc(CNC(=O)c2ccc(Cl)nn2)s1
InChIInChI=1S/C10H9ClN4OS/c1-6-12-4-7(17-6)5-13-10(16)8-2-3-9(11)15-14-8/h2-4H,5H2,1H3,(H,13,16)
InChIKeyNZDLPDXGMAFJSW-UHFFFAOYSA-N
XLogP1.82
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.73
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide
CID 61052923
2-chloro-6-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidine-4-carboxamide
CID 114219521
4-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]benzamide
CID 39855026
5-[[[5-[(6-chloro-3-pyridinyl)-(sulfinatoamino)methyl]pyridine-2-carbonyl]amino]methyl]-2-methyl-1,3-thiazole
CID 118072517
2,5-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]benzamide
CID 39855023
5-chloro-2-fluoro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]benzamide
CID 61225336
5-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]thiophene-2-carboxamide
CID 39855027
6-chloro-N-[(2-methylphenyl)methyl]pyridazine-3-carboxamide
CID 54944461
2-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide
CID 61280250
6-amino-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrazine-2-carboxamide
CID 114035828
2-hydrazinyl-6-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidine-4-carboxamide
CID 114220560
5-[(2,6-dichlorophenoxy)methyl]-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1,2-oxazole-3-carboxamide
CID 155949179

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide (CID 61282849) is 6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide is Cc1ncc(CNC(=O)c2ccc(Cl)nn2)s1.
What is the InChIKey of 6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide?
The InChIKey is NZDLPDXGMAFJSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN4OS/c1-6-12-4-7(17-6)5-13-10(16)8-2-3-9(11)15-14-8/h2-4H,5H2,1H3,(H,13,16).
What are the key properties of 6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide?
6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide has a molecular weight of 268.73 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridazine-3-carboxamide is sourced from PubChem (CID 61282849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).