6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide

C16H20N4O — CID 109124730

IUPAC6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(NC(C)(C)C)nn2)cc1
InChIInChI=1S/C16H20N4O/c1-11-5-7-12(8-6-11)17-15(21)13-9-10-14(20-19-13)18-16(2,3)4/h5-10H,1-4H3,(H,17,21)(H,18,20)
InChIKeyDBCDIFCGGCMAPI-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.25
Rot. Bonds3

About 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide

6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide (PubChem CID 109124730) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide
PubChem CID109124730
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(NC(C)(C)C)nn2)cc1
InChIInChI=1S/C16H20N4O/c1-11-5-7-12(8-6-11)17-15(21)13-9-10-14(20-19-13)18-16(2,3)4/h5-10H,1-4H3,(H,17,21)(H,18,20)
InChIKeyDBCDIFCGGCMAPI-UHFFFAOYSA-N
XLogP3.25
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-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

6-(methylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 62165036
6-(4-methylanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109127010
6-(tert-butylamino)-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109124776
N-tert-butyl-6-(4-methylanilino)pyridazine-3-carboxamide
CID 109124849
6-(tert-butylamino)-N-(4-methylphenyl)pyrimidine-4-carboxamide
CID 109353739
6-(tert-butylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridazine-3-carboxamide
CID 109124832
6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109119831
4-(tert-butylamino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109216961
6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide
CID 109126943
6-[2-(4-methoxyphenyl)ethylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109122465
ethyl 4-[[6-[(4-methylphenyl)carbamoyl]pyridazin-3-yl]amino]benzoate
CID 109127130
6-(tert-butylamino)-N-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 109124777

Frequently Asked Questions

What is the IUPAC name of 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide (CID 109124730) is 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide is Cc1ccc(NC(=O)c2ccc(NC(C)(C)C)nn2)cc1.
What is the InChIKey of 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide?
The InChIKey is DBCDIFCGGCMAPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-11-5-7-12(8-6-11)17-15(21)13-9-10-14(20-19-13)18-16(2,3)4/h5-10H,1-4H3,(H,17,21)(H,18,20).
What are the key properties of 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide?
6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 3.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109124730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).