6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide

C16H20N4O — CID 109109300

IUPAC6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide
SMILESCCCNC(=O)c1ccc(Nc2cc(C)cc(C)c2)nn1
InChIInChI=1S/C16H20N4O/c1-4-7-17-16(21)14-5-6-15(20-19-14)18-13-9-11(2)8-12(3)10-13/h5-6,8-10H,4,7H2,1-3H3,(H,17,21)(H,18,20)
InChIKeyYSKBHKIXTVCLIK-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.98
Rot. Bonds5

About 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide

6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide (PubChem CID 109109300) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide
PubChem CID109109300
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide
SMILESCCCNC(=O)c1ccc(Nc2cc(C)cc(C)c2)nn1
InChIInChI=1S/C16H20N4O/c1-4-7-17-16(21)14-5-6-15(20-19-14)18-13-9-11(2)8-12(3)10-13/h5-6,8-10H,4,7H2,1-3H3,(H,17,21)(H,18,20)
InChIKeyYSKBHKIXTVCLIK-UHFFFAOYSA-N
XLogP2.98
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(dimethylamino)ethyl]-6-(3,5-dimethylanilino)pyridazine-3-carboxamide
CID 109115410
6-(4-acetylanilino)-N-propylpyridazine-3-carboxamide
CID 109109344
6-(3-bromo-4-methylanilino)-N-butylpyridazine-3-carboxamide
CID 109110894
N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62172507
6-(4-ethoxyanilino)-N-propylpyridazine-3-carboxamide
CID 109109333
6-(2,4-dichloroanilino)-N-propylpyridazine-3-carboxamide
CID 109109379
6-(1,3-benzodioxol-5-ylamino)-N-propylpyridazine-3-carboxamide
CID 109109368
6-anilino-N-butylpyridazine-3-carboxamide
CID 109110857
N-(2,6-difluorophenyl)-6-(3,5-dimethylanilino)pyridazine-3-carboxamide
CID 109127733
6-methyl-N-propylpyridazine-3-carboxamide
CID 110705181
6-(3,5-dimethylanilino)-N-(oxolan-2-ylmethyl)pyridazine-3-carboxamide
CID 109115053
N-(4-acetylphenyl)-6-(3,5-dimethylanilino)pyridazine-3-carboxamide
CID 109127716

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide?
The IUPAC name of 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide (CID 109109300) is 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide.
What is the SMILES notation for 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide?
The canonical SMILES for 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide is CCCNC(=O)c1ccc(Nc2cc(C)cc(C)c2)nn1.
What is the InChIKey of 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide?
The InChIKey is YSKBHKIXTVCLIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-4-7-17-16(21)14-5-6-15(20-19-14)18-13-9-11(2)8-12(3)10-13/h5-6,8-10H,4,7H2,1-3H3,(H,17,21)(H,18,20).
What are the key properties of 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide?
6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide is sourced from PubChem (CID 109109300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).