4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide

C8H15N7O — CID 602539

IUPAC4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide
SMILESCN(C)c1nc(C(=O)NN)nc(N(C)C)n1
InChIInChI=1S/C8H15N7O/c1-14(2)7-10-5(6(16)13-9)11-8(12-7)15(3)4/h9H2,1-4H3,(H,13,16)
InChIKeyFPCRQGGTYHOGFK-UHFFFAOYSA-N
MW225.26 g/mol
LogP-1.39
Rot. Bonds3

About 4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide

4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide (PubChem CID 602539) has the molecular formula C8H15N7O and a molecular weight of 225.26 g/mol. Its IUPAC name is 4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide.

Molecular Properties

Compound Name4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide
PubChem CID602539
Molecular FormulaC8H15N7O
Molecular Weight225.26 g/mol
Exact Mass225.13
IUPAC Name4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide
SMILESCN(C)c1nc(C(=O)NN)nc(N(C)C)n1
InChIInChI=1S/C8H15N7O/c1-14(2)7-10-5(6(16)13-9)11-8(12-7)15(3)4/h9H2,1-4H3,(H,13,16)
InChIKeyFPCRQGGTYHOGFK-UHFFFAOYSA-N
XLogP-1.39
TPSA100.27 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 5-1.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide?
The IUPAC name of 4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide (CID 602539) is 4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide.
What is the SMILES notation for 4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide?
The canonical SMILES for 4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide is CN(C)c1nc(C(=O)NN)nc(N(C)C)n1.
What is the InChIKey of 4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide?
The InChIKey is FPCRQGGTYHOGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N7O/c1-14(2)7-10-5(6(16)13-9)11-8(12-7)15(3)4/h9H2,1-4H3,(H,13,16).
What are the key properties of 4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide?
4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide has a molecular weight of 225.26 g/mol, XLogP of -1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide is sourced from PubChem (CID 602539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).