6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide

C15H19N5O — CID 79006061

IUPAC6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide
SMILESCN(CCCNc1ccc(C(N)=O)nn1)c1ccccc1
InChIInChI=1S/C15H19N5O/c1-20(12-6-3-2-4-7-12)11-5-10-17-14-9-8-13(15(16)21)18-19-14/h2-4,6-9H,5,10-11H2,1H3,(H2,16,21)(H,17,19)
InChIKeyLZVGCZFKVNXXQD-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.51
Rot. Bonds7

About 6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide

6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide (PubChem CID 79006061) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide
PubChem CID79006061
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide
SMILESCN(CCCNc1ccc(C(N)=O)nn1)c1ccccc1
InChIInChI=1S/C15H19N5O/c1-20(12-6-3-2-4-7-12)11-5-10-17-14-9-8-13(15(16)21)18-19-14/h2-4,6-9H,5,10-11H2,1H3,(H2,16,21)(H,17,19)
InChIKeyLZVGCZFKVNXXQD-UHFFFAOYSA-N
XLogP1.51
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
CID 109115782
6-[3-(methanesulfonamido)propylamino]pyridazine-3-carboxamide
CID 113246651
methyl 6-[3-(dimethylamino)propylamino]pyridazine-3-carboxylate
CID 60792902
2-[3-(N-methylanilino)propylamino]benzenecarbothioamide
CID 28601359
N-[(2-chlorophenyl)methyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
CID 109115796
6-(2-acetamidoethylamino)pyridazine-3-carboxamide
CID 79769956
6-(2-phenylpropylamino)pyridazine-3-carboxamide
CID 112695970
6-(hex-5-ynylamino)pyridazine-3-carboxamide
CID 103757420
6-(3-cyclopropylpropylamino)pyridazine-3-carboxamide
CID 115667673
6-(3-hydroxypropylamino)pyridazine-3-carboxylic acid
CID 62487995
N-(6-hydrazinylpyrimidin-4-yl)-N'-methyl-N'-phenylpropane-1,3-diamine
CID 80932869
4-[3-(N-methylanilino)propylamino]-3-nitrobenzamide
CID 9108749

Frequently Asked Questions

What is the IUPAC name of 6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide?
The IUPAC name of 6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide (CID 79006061) is 6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide.
What is the SMILES notation for 6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide?
The canonical SMILES for 6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide is CN(CCCNc1ccc(C(N)=O)nn1)c1ccccc1.
What is the InChIKey of 6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide?
The InChIKey is LZVGCZFKVNXXQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-20(12-6-3-2-4-7-12)11-5-10-17-14-9-8-13(15(16)21)18-19-14/h2-4,6-9H,5,10-11H2,1H3,(H2,16,21)(H,17,19).
What are the key properties of 6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide?
6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.51, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(N-methylanilino)propylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 79006061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).