6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine

C10H21N7 — CID 70635023

IUPAC6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
SMILESCNNc1nc(NC(C)C)nc(NC(C)C)n1
InChIInChI=1S/C10H21N7/c1-6(2)12-8-14-9(13-7(3)4)16-10(15-8)17-11-5/h6-7,11H,1-5H3,(H3,12,13,14,15,16,17)
InChIKeyZKHCMYSWFPCDIU-UHFFFAOYSA-N
MW239.33 g/mol
LogP1.06
Rot. Bonds6

About 6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine

6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 70635023) has the molecular formula C10H21N7 and a molecular weight of 239.33 g/mol. Its IUPAC name is 6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
PubChem CID70635023
Molecular FormulaC10H21N7
Molecular Weight239.33 g/mol
Exact Mass239.19
IUPAC Name6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
SMILESCNNc1nc(NC(C)C)nc(NC(C)C)n1
InChIInChI=1S/C10H21N7/c1-6(2)12-8-14-9(13-7(3)4)16-10(15-8)17-11-5/h6-7,11H,1-5H3,(H3,12,13,14,15,16,17)
InChIKeyZKHCMYSWFPCDIU-UHFFFAOYSA-N
XLogP1.06
TPSA86.79 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.33
LogP ≤ 51.06
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine (CID 70635023) is 6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine is CNNc1nc(NC(C)C)nc(NC(C)C)n1.
What is the InChIKey of 6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is ZKHCMYSWFPCDIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N7/c1-6(2)12-8-14-9(13-7(3)4)16-10(15-8)17-11-5/h6-7,11H,1-5H3,(H3,12,13,14,15,16,17).
What are the key properties of 6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine?
6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 239.33 g/mol, XLogP of 1.06, 6 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 70635023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).