N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide

C11H15N5O2 — CID 43546468

IUPACN-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
SMILESCc1n[nH]c(C)c1NC(=O)C1=NN(C)C(=O)CC1
InChIInChI=1S/C11H15N5O2/c1-6-10(7(2)14-13-6)12-11(18)8-4-5-9(17)16(3)15-8/h4-5H2,1-3H3,(H,12,18)(H,13,14)
InChIKeyWKYBLCUOLJLNAP-UHFFFAOYSA-N
MW249.27 g/mol
LogP0.57
Rot. Bonds2

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

N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide (PubChem CID 43546468) has the molecular formula C11H15N5O2 and a molecular weight of 249.27 g/mol. Its IUPAC name is N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
PubChem CID43546468
Molecular FormulaC11H15N5O2
Molecular Weight249.27 g/mol
Exact Mass249.12
IUPAC NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
SMILESCc1n[nH]c(C)c1NC(=O)C1=NN(C)C(=O)CC1
InChIInChI=1S/C11H15N5O2/c1-6-10(7(2)14-13-6)12-11(18)8-4-5-9(17)16(3)15-8/h4-5H2,1-3H3,(H,12,18)(H,13,14)
InChIKeyWKYBLCUOLJLNAP-UHFFFAOYSA-N
XLogP0.57
TPSA90.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide (CID 43546468) is N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide.
What is the SMILES notation for N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The canonical SMILES for N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide is Cc1n[nH]c(C)c1NC(=O)C1=NN(C)C(=O)CC1.
What is the InChIKey of N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The InChIKey is WKYBLCUOLJLNAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2/c1-6-10(7(2)14-13-6)12-11(18)8-4-5-9(17)16(3)15-8/h4-5H2,1-3H3,(H,12,18)(H,13,14).
What are the key properties of N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide?
N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide has a molecular weight of 249.27 g/mol, XLogP of 0.57, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide is sourced from PubChem (CID 43546468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).