6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine

C12H23N7 — CID 80902737

IUPAC6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
SMILESCN(C)c1nc(NN)nc(NC2(C)CCCCC2)n1
InChIInChI=1S/C12H23N7/c1-12(7-5-4-6-8-12)17-9-14-10(18-13)16-11(15-9)19(2)3/h4-8,13H2,1-3H3,(H2,14,15,16,17,18)
InChIKeyDUNKMDHXJAFABN-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.36
Rot. Bonds4

About 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine

6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine (PubChem CID 80902737) has the molecular formula C12H23N7 and a molecular weight of 265.36 g/mol. Its IUPAC name is 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
PubChem CID80902737
Molecular FormulaC12H23N7
Molecular Weight265.36 g/mol
Exact Mass265.20
IUPAC Name6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
SMILESCN(C)c1nc(NN)nc(NC2(C)CCCCC2)n1
InChIInChI=1S/C12H23N7/c1-12(7-5-4-6-8-12)17-9-14-10(18-13)16-11(15-9)19(2)3/h4-8,13H2,1-3H3,(H2,14,15,16,17,18)
InChIKeyDUNKMDHXJAFABN-UHFFFAOYSA-N
XLogP1.36
TPSA91.99 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'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 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine (CID 80902737) is 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine is CN(C)c1nc(NN)nc(NC2(C)CCCCC2)n1.
What is the InChIKey of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is DUNKMDHXJAFABN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N7/c1-12(7-5-4-6-8-12)17-9-14-10(18-13)16-11(15-9)19(2)3/h4-8,13H2,1-3H3,(H2,14,15,16,17,18).
What are the key properties of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine?
6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 265.36 g/mol, XLogP of 1.36, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80902737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).