3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide

C10H11N5O — CID 115875480

IUPAC3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide
SMILESCc1cc(C(=O)Nc2cn[nH]c2)c(C)nn1
InChIInChI=1S/C10H11N5O/c1-6-3-9(7(2)15-14-6)10(16)13-8-4-11-12-5-8/h3-5H,1-2H3,(H,11,12)(H,13,16)
InChIKeyRTMGZFXXWSCIAM-UHFFFAOYSA-N
MW217.23 g/mol
LogP1.07
Rot. Bonds2

About 3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide

3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide (PubChem CID 115875480) has the molecular formula C10H11N5O and a molecular weight of 217.23 g/mol. Its IUPAC name is 3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide.

Molecular Properties

Compound Name3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide
PubChem CID115875480
Molecular FormulaC10H11N5O
Molecular Weight217.23 g/mol
Exact Mass217.10
IUPAC Name3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide
SMILESCc1cc(C(=O)Nc2cn[nH]c2)c(C)nn1
InChIInChI=1S/C10H11N5O/c1-6-3-9(7(2)15-14-6)10(16)13-8-4-11-12-5-8/h3-5H,1-2H3,(H,11,12)(H,13,16)
InChIKeyRTMGZFXXWSCIAM-UHFFFAOYSA-N
XLogP1.07
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-6-methyl-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 81225722
2-bromo-5-methyl-N-(1H-pyrazol-4-yl)benzamide
CID 80980041
N-(6-bromo-3-pyridinyl)-3,6-dimethylpyridazine-4-carboxamide
CID 103881040
N-[4-(hydroxymethyl)phenyl]-3,6-dimethylpyridazine-4-carboxamide
CID 104671138
3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide
CID 43429619
N-(4-formylphenyl)-3,6-dimethylpyridazine-4-carboxamide
CID 106912144
1H-pyrazol-4-ylcarbamic acid
CID 66846919
1H-pyrazol-4-ylcarbamic acid
CID 66846920
N-[4-(aminomethyl)phenyl]-3,6-dimethylpyridazine-4-carboxamide
CID 104668843
3,4-dimethyl-N-(1H-pyrazol-4-yl)benzamide
CID 43429529
N-(4-hydroxy-2,5-dimethylphenyl)-3,6-dimethylpyridazine-4-carboxamide
CID 136762066
N-[4-[(Z)-N'-hydroxycarbamimidoyl]-1H-pyrazol-5-yl]-3,6-dimethylpyridazine-4-carboxamide
CID 136905920

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide?
The IUPAC name of 3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide (CID 115875480) is 3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide.
What is the SMILES notation for 3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide?
The canonical SMILES for 3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide is Cc1cc(C(=O)Nc2cn[nH]c2)c(C)nn1.
What is the InChIKey of 3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide?
The InChIKey is RTMGZFXXWSCIAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O/c1-6-3-9(7(2)15-14-6)10(16)13-8-4-11-12-5-8/h3-5H,1-2H3,(H,11,12)(H,13,16).
What are the key properties of 3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide?
3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide has a molecular weight of 217.23 g/mol, XLogP of 1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide is sourced from PubChem (CID 115875480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).