N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide

C17H16N4O — CID 133329112

IUPACN-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCc2cccc3ccccc23)nn1
InChIInChI=1S/C17H16N4O/c1-18-17(22)15-9-10-16(21-20-15)19-11-13-7-4-6-12-5-2-3-8-14(12)13/h2-10H,11H2,1H3,(H,18,22)(H,19,21)
InChIKeyFHAUTEWWSPRNDV-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.60
Rot. Bonds4

About N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide

N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide (PubChem CID 133329112) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide
PubChem CID133329112
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC NameN-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCc2cccc3ccccc23)nn1
InChIInChI=1S/C17H16N4O/c1-18-17(22)15-9-10-16(21-20-15)19-11-13-7-4-6-12-5-2-3-8-14(12)13/h2-10H,11H2,1H3,(H,18,22)(H,19,21)
InChIKeyFHAUTEWWSPRNDV-UHFFFAOYSA-N
XLogP2.60
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-6-[(2-nitrophenyl)methylamino]pyridazine-3-carboxamide
CID 79211634
N-methyl-6-(naphthalen-2-ylmethylamino)pyridazine-3-carboxamide
CID 133328883
N-methyl-6-[(2-phenoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 133329071
6-[(4-hydroxyphenyl)methylamino]-N-methylpyridazine-3-carboxamide
CID 115669027
N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 133343379
N-methyl-6-[(4-phenylsulfanylphenyl)methylamino]pyridazine-3-carboxamide
CID 133397231
6-[(2-methylphenyl)methylamino]pyridazine-3-carboxylic acid
CID 54944511
6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid
CID 62369628
N-[2-(1H-indol-3-yl)ethyl]-6-[(2-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109118016
N-tert-butyl-6-[(2-methoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 109119978
6-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylamino]-N-methylpyridazine-3-carboxamide
CID 133339646
N-methyl-6-(1H-1,2,4-triazol-5-ylmethylamino)pyridazine-3-carboxamide
CID 79208438

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide (CID 133329112) is N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide is CNC(=O)c1ccc(NCc2cccc3ccccc23)nn1.
What is the InChIKey of N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide?
The InChIKey is FHAUTEWWSPRNDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c1-18-17(22)15-9-10-16(21-20-15)19-11-13-7-4-6-12-5-2-3-8-14(12)13/h2-10H,11H2,1H3,(H,18,22)(H,19,21).
What are the key properties of N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide?
N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 133329112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).