N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide

C12H15N5O — CID 113344588

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide
SMILESCc1cc(C(=O)Nc2n[nH]c(C)c2C)c(C)nn1
InChIInChI=1S/C12H15N5O/c1-6-5-10(9(4)16-14-6)12(18)13-11-7(2)8(3)15-17-11/h5H,1-4H3,(H2,13,15,17,18)
InChIKeyOJSIYPILBSTXQB-UHFFFAOYSA-N
MW245.29 g/mol
LogP1.69
Rot. Bonds2

About N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide

N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide (PubChem CID 113344588) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide
PubChem CID113344588
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide
SMILESCc1cc(C(=O)Nc2n[nH]c(C)c2C)c(C)nn1
InChIInChI=1S/C12H15N5O/c1-6-5-10(9(4)16-14-6)12(18)13-11-7(2)8(3)15-17-11/h5H,1-4H3,(H2,13,15,17,18)
InChIKeyOJSIYPILBSTXQB-UHFFFAOYSA-N
XLogP1.69
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide (CID 113344588) is N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide is Cc1cc(C(=O)Nc2n[nH]c(C)c2C)c(C)nn1.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide?
The InChIKey is OJSIYPILBSTXQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-6-5-10(9(4)16-14-6)12(18)13-11-7(2)8(3)15-17-11/h5H,1-4H3,(H2,13,15,17,18).
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide?
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide has a molecular weight of 245.29 g/mol, XLogP of 1.69, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3,6-dimethylpyridazine-4-carboxamide is sourced from PubChem (CID 113344588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).