5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide

C15H20N4O — CID 102705170

IUPAC5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
SMILESCc1cc(C)c(C(=O)Nc2c(C)nn(C)c2C)cc1N
InChIInChI=1S/C15H20N4O/c1-8-6-9(2)13(16)7-12(8)15(20)17-14-10(3)18-19(5)11(14)4/h6-7H,16H2,1-5H3,(H,17,20)
InChIKeyDNXLXQFQMGCADE-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.49
Rot. Bonds2

About 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide

5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide (PubChem CID 102705170) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide.

Molecular Properties

Compound Name5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
PubChem CID102705170
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
SMILESCc1cc(C)c(C(=O)Nc2c(C)nn(C)c2C)cc1N
InChIInChI=1S/C15H20N4O/c1-8-6-9(2)13(16)7-12(8)15(20)17-14-10(3)18-19(5)11(14)4/h6-7H,16H2,1-5H3,(H,17,20)
InChIKeyDNXLXQFQMGCADE-UHFFFAOYSA-N
XLogP2.49
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide 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

5-amino-2-chloro-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
CID 61110943
5-amino-N-(4-bromo-2,6-dimethylphenyl)-2,4-dimethylbenzamide
CID 102704950
2,5-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)furan-3-carboxamide
CID 24655014
N-(5-amino-2,4-dimethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 104757095
5-amino-N-(2,6-dibromo-4-methylphenyl)-2,4-dimethylbenzamide
CID 102704977
3-amino-N-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrazole-5-carboxamide
CID 64524039
4-bromo-1-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pyrrole-2-carboxamide
CID 60698314
5-amino-2,4-dimethyl-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 102704945
5-amino-N-(1,3,5-trimethylpyrazol-4-yl)-1-benzofuran-2-carboxamide
CID 61113384
2,4-dimethyl-6-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyran-3-carboxamide
CID 3773292
N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide
CID 35283696
3-methyl-4-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
CID 9247878

Frequently Asked Questions

What is the IUPAC name of 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
The IUPAC name of 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide (CID 102705170) is 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide.
What is the SMILES notation for 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
The canonical SMILES for 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide is Cc1cc(C)c(C(=O)Nc2c(C)nn(C)c2C)cc1N.
What is the InChIKey of 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
The InChIKey is DNXLXQFQMGCADE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-8-6-9(2)13(16)7-12(8)15(20)17-14-10(3)18-19(5)11(14)4/h6-7H,16H2,1-5H3,(H,17,20).
What are the key properties of 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide has a molecular weight of 272.35 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide is sourced from PubChem (CID 102705170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).