6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide

C19H20N4O2 — CID 10131846

IUPAC6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ccc(C3=NNC(=O)CC3C)c(C)c2)n1
InChIInChI=1S/C19H20N4O2/c1-11-9-14(21-19(25)16-6-4-5-13(3)20-16)7-8-15(11)18-12(2)10-17(24)22-23-18/h4-9,12H,10H2,1-3H3,(H,21,25)(H,22,24)
InChIKeyHDGLRQQWYMZMKS-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.81
Rot. Bonds3

About 6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide

6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide (PubChem CID 10131846) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide
PubChem CID10131846
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ccc(C3=NNC(=O)CC3C)c(C)c2)n1
InChIInChI=1S/C19H20N4O2/c1-11-9-14(21-19(25)16-6-4-5-13(3)20-16)7-8-15(11)18-12(2)10-17(24)22-23-18/h4-9,12H,10H2,1-3H3,(H,21,25)(H,22,24)
InChIKeyHDGLRQQWYMZMKS-UHFFFAOYSA-N
XLogP2.81
TPSA83.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide (CID 10131846) is 6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide is Cc1cccc(C(=O)Nc2ccc(C3=NNC(=O)CC3C)c(C)c2)n1.
What is the InChIKey of 6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide?
The InChIKey is HDGLRQQWYMZMKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-11-9-14(21-19(25)16-6-4-5-13(3)20-16)7-8-15(11)18-12(2)10-17(24)22-23-18/h4-9,12H,10H2,1-3H3,(H,21,25)(H,22,24).
What are the key properties of 6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide?
6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide has a molecular weight of 336.40 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[3-methyl-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 10131846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).