6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide

C11H10ClN5O2 — CID 107605634

IUPAC6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide
SMILESCOc1cc(C)nc(NC(=O)c2ccc(Cl)nn2)n1
InChIInChI=1S/C11H10ClN5O2/c1-6-5-9(19-2)14-11(13-6)15-10(18)7-3-4-8(12)17-16-7/h3-5H,1-2H3,(H,13,14,15,18)
InChIKeyNMZSNCJMCZSGPH-UHFFFAOYSA-N
MW279.69 g/mol
LogP1.49
Rot. Bonds3

About 6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide

6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide (PubChem CID 107605634) has the molecular formula C11H10ClN5O2 and a molecular weight of 279.69 g/mol. Its IUPAC name is 6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide
PubChem CID107605634
Molecular FormulaC11H10ClN5O2
Molecular Weight279.69 g/mol
Exact Mass279.05
IUPAC Name6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide
SMILESCOc1cc(C)nc(NC(=O)c2ccc(Cl)nn2)n1
InChIInChI=1S/C11H10ClN5O2/c1-6-5-9(19-2)14-11(13-6)15-10(18)7-3-4-8(12)17-16-7/h3-5H,1-2H3,(H,13,14,15,18)
InChIKeyNMZSNCJMCZSGPH-UHFFFAOYSA-N
XLogP1.49
TPSA89.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.69
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-chloro-2-hydroxy-N-(4-methoxy-6-methylpyrimidin-2-yl)benzamide
CID 107600816
2-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)-6-(methylamino)pyridine-4-carboxamide
CID 107603438
6-hydrazinyl-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridine-2-carboxamide
CID 107603520
3,4-dihydroxy-N-(4-methoxy-6-methylpyrimidin-2-yl)benzamide
CID 107728577
N-(4-methoxy-6-methylpyrimidin-2-yl)-4-(methylamino)benzamide
CID 107603439
2-hydroxy-5-methoxy-N-(4-methoxy-6-methylpyrimidin-2-yl)benzamide
CID 107600817
3-bromo-N-(4-methoxy-6-methylpyrimidin-2-yl)benzamide
CID 103916876
3-amino-N-(4-methoxy-6-methylpyrimidin-2-yl)-4-methylbenzamide
CID 107600220
2-amino-N-(4-methoxy-6-methylpyrimidin-2-yl)-5-methylbenzamide
CID 107600113
2-amino-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridine-4-carboxamide
CID 107603408
2-hydrazinyl-N-(4-methoxy-6-methylpyrimidin-2-yl)-2-oxoacetamide
CID 107602431
N-(4-chloro-6-methoxypyrimidin-2-yl)-3-methylbenzamide
CID 114053555

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide (CID 107605634) is 6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide is COc1cc(C)nc(NC(=O)c2ccc(Cl)nn2)n1.
What is the InChIKey of 6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide?
The InChIKey is NMZSNCJMCZSGPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN5O2/c1-6-5-9(19-2)14-11(13-6)15-10(18)7-3-4-8(12)17-16-7/h3-5H,1-2H3,(H,13,14,15,18).
What are the key properties of 6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide?
6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide has a molecular weight of 279.69 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 107605634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).