2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine

C11H22N6 — CID 112746105

IUPAC2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine
SMILESCC(C)CC(CN(C)C)Nc1ncnc(N)n1
InChIInChI=1S/C11H22N6/c1-8(2)5-9(6-17(3)4)15-11-14-7-13-10(12)16-11/h7-9H,5-6H2,1-4H3,(H3,12,13,14,15,16)
InChIKeyASSVVQFDOUNXJE-UHFFFAOYSA-N
MW238.34 g/mol
LogP0.84
Rot. Bonds6

About 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine

2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine (PubChem CID 112746105) has the molecular formula C11H22N6 and a molecular weight of 238.34 g/mol. Its IUPAC name is 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine
PubChem CID112746105
Molecular FormulaC11H22N6
Molecular Weight238.34 g/mol
Exact Mass238.19
IUPAC Name2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine
SMILESCC(C)CC(CN(C)C)Nc1ncnc(N)n1
InChIInChI=1S/C11H22N6/c1-8(2)5-9(6-17(3)4)15-11-14-7-13-10(12)16-11/h7-9H,5-6H2,1-4H3,(H3,12,13,14,15,16)
InChIKeyASSVVQFDOUNXJE-UHFFFAOYSA-N
XLogP0.84
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.34
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine with MolForge

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

Launch Full Analysis

Related Compounds

6-bromo-2-N-[1-(dimethylamino)-4-methylpentan-2-yl]pyrimidine-2,4-diamine
CID 116795711
2-N-(3-methylbutyl)-1,3,5-triazine-2,4-diamine
CID 11972200
2-[[1-(dimethylamino)-4-methylpentan-2-yl]amino]pyrimidine-4-carboxylic acid
CID 107553462
2-N-(3-methylpentan-2-yl)-1,3,5-triazine-2,4-diamine
CID 130532591
4-N-[1-(dimethylamino)-4-methylpentan-2-yl]-6-N,5-diethylpyrimidine-4,6-diamine
CID 80782621
3,5-dichloro-6-N-[1-(dimethylamino)-4-methylpentan-2-yl]pyridine-2,6-diamine
CID 102757090
2-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1-N,1-N,4-trimethylpentane-1,2-diamine
CID 105362544
5-bromo-2-N-[1-(dimethylamino)-4-methylpentan-2-yl]pyridine-2,3-diamine
CID 54963875
4-N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-N,5-dimethylpyrimidine-2,4-diamine
CID 80808240
3-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1-methylpyrazole-3,4-diamine
CID 103078240
1-N,1-N,4-trimethyl-2-N-(4-methyl-6-propoxypyrimidin-2-yl)pentane-1,2-diamine
CID 115974797
2-[[1-(dimethylamino)-4-methylpentan-2-yl]amino]-6-methylpyrimidine-4-carbonitrile
CID 107544009

Frequently Asked Questions

What is the IUPAC name of 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine (CID 112746105) is 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine is CC(C)CC(CN(C)C)Nc1ncnc(N)n1.
What is the InChIKey of 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine?
The InChIKey is ASSVVQFDOUNXJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N6/c1-8(2)5-9(6-17(3)4)15-11-14-7-13-10(12)16-11/h7-9H,5-6H2,1-4H3,(H3,12,13,14,15,16).
What are the key properties of 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine?
2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine has a molecular weight of 238.34 g/mol, XLogP of 0.84, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 112746105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).