N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide

C19H18N4O2 — CID 133343379

IUPACN-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCc2ccc(Oc3ccccc3)cc2)nn1
InChIInChI=1S/C19H18N4O2/c1-20-19(24)17-11-12-18(23-22-17)21-13-14-7-9-16(10-8-14)25-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,20,24)(H,21,23)
InChIKeyZDFQHPWDRKLQNY-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.24
Rot. Bonds6

About N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide

N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide (PubChem CID 133343379) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide
PubChem CID133343379
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC NameN-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCc2ccc(Oc3ccccc3)cc2)nn1
InChIInChI=1S/C19H18N4O2/c1-20-19(24)17-11-12-18(23-22-17)21-13-14-7-9-16(10-8-14)25-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,20,24)(H,21,23)
InChIKeyZDFQHPWDRKLQNY-UHFFFAOYSA-N
XLogP3.24
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-6-[(2-phenoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 133329071
N-methyl-6-[(4-phenylsulfanylphenyl)methylamino]pyridazine-3-carboxamide
CID 133397231
6-[(4-hydroxyphenyl)methylamino]-N-methylpyridazine-3-carboxamide
CID 115669027
N-methyl-6-(naphthalen-2-ylmethylamino)pyridazine-3-carboxamide
CID 133328883
N-methyl-6-[(4-nitrophenyl)methylamino]pyridazine-3-carboxamide
CID 79211637
N-methyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide
CID 106486781
6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide
CID 79005945
6-[(4-methoxyphenyl)methylamino]-N-propan-2-ylpyridazine-3-carboxamide
CID 109109629
N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide
CID 133329112
6-[(4-bromo-3-fluorophenyl)methylamino]-N-methylpyridazine-3-carboxamide
CID 133342969
6-[(4-methoxyphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyridazine-3-carboxamide
CID 109120160
N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041752

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide (CID 133343379) is N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide is CNC(=O)c1ccc(NCc2ccc(Oc3ccccc3)cc2)nn1.
What is the InChIKey of N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide?
The InChIKey is ZDFQHPWDRKLQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-20-19(24)17-11-12-18(23-22-17)21-13-14-7-9-16(10-8-14)25-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,20,24)(H,21,23).
What are the key properties of N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide?
N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.24, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 133343379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).