4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine

C11H20N6O — CID 80895205

IUPAC4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(NN)nc(NC2CCCC(C)C2)n1
InChIInChI=1S/C11H20N6O/c1-7-4-3-5-8(6-7)13-9-14-10(17-12)16-11(15-9)18-2/h7-8H,3-6,12H2,1-2H3,(H2,13,14,15,16,17)
InChIKeyHDFZCHWVTOQDTA-UHFFFAOYSA-N
MW252.32 g/mol
LogP1.16
Rot. Bonds4

About 4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine

4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine (PubChem CID 80895205) has the molecular formula C11H20N6O and a molecular weight of 252.32 g/mol. Its IUPAC name is 4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine
PubChem CID80895205
Molecular FormulaC11H20N6O
Molecular Weight252.32 g/mol
Exact Mass252.17
IUPAC Name4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(NN)nc(NC2CCCC(C)C2)n1
InChIInChI=1S/C11H20N6O/c1-7-4-3-5-8(6-7)13-9-14-10(17-12)16-11(15-9)18-2/h7-8H,3-6,12H2,1-2H3,(H2,13,14,15,16,17)
InChIKeyHDFZCHWVTOQDTA-UHFFFAOYSA-N
XLogP1.16
TPSA97.98 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 51.16
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 4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine (CID 80895205) is 4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine is COc1nc(NN)nc(NC2CCCC(C)C2)n1.
What is the InChIKey of 4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine?
The InChIKey is HDFZCHWVTOQDTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O/c1-7-4-3-5-8(6-7)13-9-14-10(17-12)16-11(15-9)18-2/h7-8H,3-6,12H2,1-2H3,(H2,13,14,15,16,17).
What are the key properties of 4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine?
4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine has a molecular weight of 252.32 g/mol, XLogP of 1.16, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80895205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).