6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide

C15H13ClN4O3 — CID 87051171

IUPAC6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cn3nc(Cl)ccc3n2)c1
InChIInChI=1S/C15H13ClN4O3/c1-22-9-3-4-12(23-2)10(7-9)18-15(21)11-8-20-14(17-11)6-5-13(16)19-20/h3-8H,1-2H3,(H,18,21)
InChIKeyDRBRXZPLGIURFA-UHFFFAOYSA-N
MW332.75 g/mol
LogP2.65
Rot. Bonds4

About 6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide

6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide (PubChem CID 87051171) has the molecular formula C15H13ClN4O3 and a molecular weight of 332.75 g/mol. Its IUPAC name is 6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide
PubChem CID87051171
Molecular FormulaC15H13ClN4O3
Molecular Weight332.75 g/mol
Exact Mass332.07
IUPAC Name6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cn3nc(Cl)ccc3n2)c1
InChIInChI=1S/C15H13ClN4O3/c1-22-9-3-4-12(23-2)10(7-9)18-15(21)11-8-20-14(17-11)6-5-13(16)19-20/h3-8H,1-2H3,(H,18,21)
InChIKeyDRBRXZPLGIURFA-UHFFFAOYSA-N
XLogP2.65
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.75
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-N-(2,5-dimethoxyphenyl)-1,3-dimethylpyrazole-5-carboxamide
CID 4278668
6-chloro-N-propan-2-ylimidazo[1,2-b]pyridazine-2-carboxamide
CID 58216634
N-(2,5-dimethoxyphenyl)-2,6-dimethylpyrimidine-4-carboxamide
CID 110860509
N-(2,5-dimethoxyphenyl)-6-methoxypyridazine-3-carboxamide
CID 90509292
N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109129150
methyl 6-[(2,5-dimethoxyphenyl)carbamoyl]pyridine-2-carboxylate
CID 46394490
N-(2,5-dimethoxyphenyl)-6-methylpyridine-2-carboxamide
CID 31808969
N-(2,5-dimethoxyphenyl)-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 84555059
N-(2,5-dimethoxyphenyl)isoquinoline-3-carboxamide
CID 110860541
6-amino-N-(2,5-dimethoxyphenyl)pyridine-2-carboxamide
CID 62241119
N-(2-acetamido-5-methoxyphenyl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 71937655
N-(2,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 1172222

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide?
The IUPAC name of 6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide (CID 87051171) is 6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide is COc1ccc(OC)c(NC(=O)c2cn3nc(Cl)ccc3n2)c1.
What is the InChIKey of 6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide?
The InChIKey is DRBRXZPLGIURFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN4O3/c1-22-9-3-4-12(23-2)10(7-9)18-15(21)11-8-20-14(17-11)6-5-13(16)19-20/h3-8H,1-2H3,(H,18,21).
What are the key properties of 6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide?
6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide has a molecular weight of 332.75 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2,5-dimethoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide is sourced from PubChem (CID 87051171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).