2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine

C7H13N5 — CID 59816813

IUPAC2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCCN(C)c1nc(C)nc(N)n1
InChIInChI=1S/C7H13N5/c1-4-12(3)7-10-5(2)9-6(8)11-7/h4H2,1-3H3,(H2,8,9,10,11)
InChIKeyYIBUDRDOKLWVNJ-UHFFFAOYSA-N
MW167.22 g/mol
LogP0.22
Rot. Bonds2

About 2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine

2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 59816813) has the molecular formula C7H13N5 and a molecular weight of 167.22 g/mol. Its IUPAC name is 2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine
PubChem CID59816813
Molecular FormulaC7H13N5
Molecular Weight167.22 g/mol
Exact Mass167.12
IUPAC Name2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCCN(C)c1nc(C)nc(N)n1
InChIInChI=1S/C7H13N5/c1-4-12(3)7-10-5(2)9-6(8)11-7/h4H2,1-3H3,(H2,8,9,10,11)
InChIKeyYIBUDRDOKLWVNJ-UHFFFAOYSA-N
XLogP0.22
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.22
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 80774543
2-N,6-dimethyl-2-N-(pyridin-4-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 166178436
6-(1-chloroethyl)-2-N-ethyl-2-N-methyl-1,3,5-triazine-2,4-diamine
CID 130568307
N-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-tert-butylthiohydroxylamine
CID 174972661
2-N,6-dimethyl-2-N-(4-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
CID 112746078
4-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine
CID 80776362
3-N-ethyl-3-N-methyl-1H-1,2,4-triazole-3,5-diamine
CID 66277105
6-ethoxy-2-N-methyl-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80776108
6-bromo-2-N-ethyl-2-N-methylpyrimidine-2,4-diamine
CID 116796401
2-N,2-N-diethyl-4-N-methyl-4-N-(2-methylsulfanylethyl)-1,3,5-triazine-2,4,6-triamine
CID 112667625
2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide
CID 80780070
2-N-[2-[[4-chloro-6-[2-[(4,6-diamino-1,3,5-triazin-2-yl)-methylamino]ethyl-methylamino]-1,3,5-triazin-2-yl]-methylamino]ethyl]-2-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 89059466

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine (CID 59816813) is 2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine is CCN(C)c1nc(C)nc(N)n1.
What is the InChIKey of 2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is YIBUDRDOKLWVNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N5/c1-4-12(3)7-10-5(2)9-6(8)11-7/h4H2,1-3H3,(H2,8,9,10,11).
What are the key properties of 2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine?
2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 167.22 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 59816813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).