2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride

C8H18ClN5 — CID 22174774

IUPAC2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride
SMILESCC1N=C(N(C)C)NC(N(C)C)=N1.Cl
InChIInChI=1S/C8H17N5.ClH/c1-6-9-7(12(2)3)11-8(10-6)13(4)5;/h6H,1-5H3,(H,9,10,11);1H
InChIKeyXYDLIZKNTRKHRO-UHFFFAOYSA-N
MW219.72 g/mol
LogP0.19
Rot. Bonds

About 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride

2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride (PubChem CID 22174774) has the molecular formula C8H18ClN5 and a molecular weight of 219.72 g/mol. Its IUPAC name is 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride.

Molecular Properties

Compound Name2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride
PubChem CID22174774
Molecular FormulaC8H18ClN5
Molecular Weight219.72 g/mol
Exact Mass219.13
IUPAC Name2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride
SMILESCC1N=C(N(C)C)NC(N(C)C)=N1.Cl
InChIInChI=1S/C8H17N5.ClH/c1-6-9-7(12(2)3)11-8(10-6)13(4)5;/h6H,1-5H3,(H,9,10,11);1H
InChIKeyXYDLIZKNTRKHRO-UHFFFAOYSA-N
XLogP0.19
TPSA43.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.72
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride?
The IUPAC name of 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride (CID 22174774) is 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride.
What is the SMILES notation for 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride?
The canonical SMILES for 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride is CC1N=C(N(C)C)NC(N(C)C)=N1.Cl.
What is the InChIKey of 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride?
The InChIKey is XYDLIZKNTRKHRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N5.ClH/c1-6-9-7(12(2)3)11-8(10-6)13(4)5;/h6H,1-5H3,(H,9,10,11);1H.
What are the key properties of 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride?
2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride has a molecular weight of 219.72 g/mol, XLogP of 0.19, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride is sourced from PubChem (CID 22174774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).