N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide

C14H13N5O — CID 115875596

IUPACN-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide
SMILESCc1cc(C(=O)Nc2n[nH]c3ccccc23)c(C)nn1
InChIInChI=1S/C14H13N5O/c1-8-7-11(9(2)17-16-8)14(20)15-13-10-5-3-4-6-12(10)18-19-13/h3-7H,1-2H3,(H2,15,18,19,20)
InChIKeyUDWDUJILMMSJMO-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.22
Rot. Bonds2

About N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide

N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide (PubChem CID 115875596) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide.

Molecular Properties

Compound NameN-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide
PubChem CID115875596
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC NameN-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide
SMILESCc1cc(C(=O)Nc2n[nH]c3ccccc23)c(C)nn1
InChIInChI=1S/C14H13N5O/c1-8-7-11(9(2)17-16-8)14(20)15-13-10-5-3-4-6-12(10)18-19-13/h3-7H,1-2H3,(H2,15,18,19,20)
InChIKeyUDWDUJILMMSJMO-UHFFFAOYSA-N
XLogP2.22
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide
CID 113344588
4-bromo-N-(1H-indazol-3-yl)-2-methylbenzamide
CID 61068511
2,5-dichloro-N-(1H-indazol-3-yl)benzamide
CID 60729962
N-(1H-indazol-3-yl)-3,4-dimethyl-6-oxo-1H-pyridazine-5-carboxamide
CID 61068182
N-(1H-indazol-3-yl)-3-methylfuran-2-carboxamide
CID 60730334
N-(1H-indazol-3-yl)-2-methylsulfanylpyridine-3-carboxamide
CID 60729732
N-(1H-indazol-3-yl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide
CID 112527835
N-(1H-indazol-3-yl)-1-methylindole-4-carboxamide
CID 112527943
4-chloro-N-(1H-indazol-3-yl)benzamide
CID 12913046
ethyl 3-(1H-indazol-3-ylamino)-3-oxopropanoate
CID 110474185
1-(1H-indazol-3-yl)-3-(3-methylphenyl)urea
CID 62686211
4-bromo-N-(1H-indazol-3-yl)-1-methylpyrrole-2-carboxamide
CID 62686203

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide?
The IUPAC name of N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide (CID 115875596) is N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide.
What is the SMILES notation for N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide?
The canonical SMILES for N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide is Cc1cc(C(=O)Nc2n[nH]c3ccccc23)c(C)nn1.
What is the InChIKey of N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide?
The InChIKey is UDWDUJILMMSJMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-8-7-11(9(2)17-16-8)14(20)15-13-10-5-3-4-6-12(10)18-19-13/h3-7H,1-2H3,(H2,15,18,19,20).
What are the key properties of N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide?
N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.22, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide is sourced from PubChem (CID 115875596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).