2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide

C19H19N5O2 — CID 70486857

IUPAC2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
SMILESCN1C(=O)N2C(=NC1(C)C)N(C(=O)Nc1ccccc1)c1ccccc12
InChIInChI=1S/C19H19N5O2/c1-19(2)21-16-23(17(25)20-13-9-5-4-6-10-13)14-11-7-8-12-15(14)24(16)18(26)22(19)3/h4-12H,1-3H3,(H,20,25)
InChIKeyRPZHMCITDVOMGS-UHFFFAOYSA-N
MW349.39 g/mol
LogP3.70
Rot. Bonds1

About 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide

2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide (PubChem CID 70486857) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide.

Molecular Properties

Compound Name2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
PubChem CID70486857
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC Name2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
SMILESCN1C(=O)N2C(=NC1(C)C)N(C(=O)Nc1ccccc1)c1ccccc12
InChIInChI=1S/C19H19N5O2/c1-19(2)21-16-23(17(25)20-13-9-5-4-6-10-13)14-11-7-8-12-15(14)24(16)18(26)22(19)3/h4-12H,1-3H3,(H,20,25)
InChIKeyRPZHMCITDVOMGS-UHFFFAOYSA-N
XLogP3.70
TPSA68.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide 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 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide?
The IUPAC name of 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide (CID 70486857) is 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide.
What is the SMILES notation for 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide?
The canonical SMILES for 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide is CN1C(=O)N2C(=NC1(C)C)N(C(=O)Nc1ccccc1)c1ccccc12.
What is the InChIKey of 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide?
The InChIKey is RPZHMCITDVOMGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c1-19(2)21-16-23(17(25)20-13-9-5-4-6-10-13)14-11-7-8-12-15(14)24(16)18(26)22(19)3/h4-12H,1-3H3,(H,20,25).
What are the key properties of 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide?
2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide has a molecular weight of 349.39 g/mol, XLogP of 3.70, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3-trimethyl-4-oxo-N-phenyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide is sourced from PubChem (CID 70486857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).