N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide

C9H6ClN5O — CID 102989245

IUPACN-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide
SMILESO=C(Nc1nccnc1Cl)c1ccnnc1
InChIInChI=1S/C9H6ClN5O/c10-7-8(12-4-3-11-7)15-9(16)6-1-2-13-14-5-6/h1-5H,(H,12,15,16)
InChIKeyRDBAVKDMBAPMIX-UHFFFAOYSA-N
MW235.63 g/mol
LogP1.17
Rot. Bonds2

About N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide

N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide (PubChem CID 102989245) has the molecular formula C9H6ClN5O and a molecular weight of 235.63 g/mol. Its IUPAC name is N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide.

Molecular Properties

Compound NameN-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide
PubChem CID102989245
Molecular FormulaC9H6ClN5O
Molecular Weight235.63 g/mol
Exact Mass235.03
IUPAC NameN-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide
SMILESO=C(Nc1nccnc1Cl)c1ccnnc1
InChIInChI=1S/C9H6ClN5O/c10-7-8(12-4-3-11-7)15-9(16)6-1-2-13-14-5-6/h1-5H,(H,12,15,16)
InChIKeyRDBAVKDMBAPMIX-UHFFFAOYSA-N
XLogP1.17
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.63
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

pyridazine-4-carbohydrazide;hydrochloride
CID 122236542
N-(3-chloropyrazin-2-yl)-1,2-oxazole-3-carboxamide
CID 102989094
N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-carboxamide
CID 102989436
3-bromo-N-(3-chloropyrazin-2-yl)-5-methylbenzamide
CID 102989546
5-chloro-N-(3-chloropyrazin-2-yl)-2-methylbenzamide
CID 102989278
N-(4-amino-5-chloro-2-methylphenyl)pyridazine-4-carboxamide
CID 113439119
N-(3-chloropyrazin-2-yl)prop-2-enamide
CID 102989286
N-(5-methyl-1H-pyrazol-3-yl)pyridazine-4-carboxamide
CID 115736164
N-(3-chloropyrazin-2-yl)-4-methyl-1,2-oxazole-5-carboxamide
CID 102989712
N-(2-carbamothioyl-5-chlorophenyl)pyridazine-4-carboxamide
CID 104670500
2-tert-butyl-N-(3-chloropyrazin-2-yl)benzamide
CID 102989374
N-(3-chloropyrazin-2-yl)-3-methoxy-4-nitrobenzamide
CID 102989249

Frequently Asked Questions

What is the IUPAC name of N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide?
The IUPAC name of N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide (CID 102989245) is N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide.
What is the SMILES notation for N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide?
The canonical SMILES for N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide is O=C(Nc1nccnc1Cl)c1ccnnc1.
What is the InChIKey of N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide?
The InChIKey is RDBAVKDMBAPMIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClN5O/c10-7-8(12-4-3-11-7)15-9(16)6-1-2-13-14-5-6/h1-5H,(H,12,15,16).
What are the key properties of N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide?
N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide has a molecular weight of 235.63 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloropyrazin-2-yl)pyridazine-4-carboxamide is sourced from PubChem (CID 102989245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).