2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide

C9H12N6O — CID 67924599

IUPAC2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide
SMILESCc1ncnc(C)n1.NC(=O)c1ncc[nH]1
InChIInChI=1S/C5H7N3.C4H5N3O/c1-4-6-3-7-5(2)8-4;5-3(8)4-6-1-2-7-4/h3H,1-2H3;1-2H,(H2,5,8)(H,6,7)
InChIKeyNYHKJHCSBZILIA-UHFFFAOYSA-N
MW220.24 g/mol
LogP-0.00
Rot. Bonds1

About 2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide

2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide (PubChem CID 67924599) has the molecular formula C9H12N6O and a molecular weight of 220.24 g/mol. Its IUPAC name is 2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide
PubChem CID67924599
Molecular FormulaC9H12N6O
Molecular Weight220.24 g/mol
Exact Mass220.11
IUPAC Name2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide
SMILESCc1ncnc(C)n1.NC(=O)c1ncc[nH]1
InChIInChI=1S/C5H7N3.C4H5N3O/c1-4-6-3-7-5(2)8-4;5-3(8)4-6-1-2-7-4/h3H,1-2H3;1-2H,(H2,5,8)(H,6,7)
InChIKeyNYHKJHCSBZILIA-UHFFFAOYSA-N
XLogP-0.00
TPSA110.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.24
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide?
The IUPAC name of 2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide (CID 67924599) is 2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide.
What is the SMILES notation for 2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide?
The canonical SMILES for 2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide is Cc1ncnc(C)n1.NC(=O)c1ncc[nH]1.
What is the InChIKey of 2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide?
The InChIKey is NYHKJHCSBZILIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3.C4H5N3O/c1-4-6-3-7-5(2)8-4;5-3(8)4-6-1-2-7-4/h3H,1-2H3;1-2H,(H2,5,8)(H,6,7).
What are the key properties of 2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide?
2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide has a molecular weight of 220.24 g/mol, XLogP of -0.00, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide is sourced from PubChem (CID 67924599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).