4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide

C16H15N5O — CID 164961032

IUPAC4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide
SMILES[H]/N=N/c1ccc(C(=O)Nc2ccc3n[nH]c(C)c3c2)cc1C
InChIInChI=1S/C16H15N5O/c1-9-7-11(3-5-14(9)19-17)16(22)18-12-4-6-15-13(8-12)10(2)20-21-15/h3-8,17H,1-2H3,(H,18,22)(H,20,21)/b19-17+
InChIKeyBVMIQHVWHAMTNG-HTXNQAPBSA-N
MW293.33 g/mol
LogP4.09
Rot. Bonds3

About 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide

4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide (PubChem CID 164961032) has the molecular formula C16H15N5O and a molecular weight of 293.33 g/mol. Its IUPAC name is 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide.

Molecular Properties

Compound Name4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide
PubChem CID164961032
Molecular FormulaC16H15N5O
Molecular Weight293.33 g/mol
Exact Mass293.13
IUPAC Name4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide
SMILES[H]/N=N/c1ccc(C(=O)Nc2ccc3n[nH]c(C)c3c2)cc1C
InChIInChI=1S/C16H15N5O/c1-9-7-11(3-5-14(9)19-17)16(22)18-12-4-6-15-13(8-12)10(2)20-21-15/h3-8,17H,1-2H3,(H,18,22)(H,20,21)/b19-17+
InChIKeyBVMIQHVWHAMTNG-HTXNQAPBSA-N
XLogP4.09
TPSA93.99 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 54.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-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

Frequently Asked Questions

What is the IUPAC name of 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide?
The IUPAC name of 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide (CID 164961032) is 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide.
What is the SMILES notation for 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide?
The canonical SMILES for 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide is [H]/N=N/c1ccc(C(=O)Nc2ccc3n[nH]c(C)c3c2)cc1C.
What is the InChIKey of 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide?
The InChIKey is BVMIQHVWHAMTNG-HTXNQAPBSA-N. The full InChI is InChI=1S/C16H15N5O/c1-9-7-11(3-5-14(9)19-17)16(22)18-12-4-6-15-13(8-12)10(2)20-21-15/h3-8,17H,1-2H3,(H,18,22)(H,20,21)/b19-17+.
What are the key properties of 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide?
4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide has a molecular weight of 293.33 g/mol, XLogP of 4.09, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide is sourced from PubChem (CID 164961032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).