2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine

C13H26N6O — CID 80770689

IUPAC2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine
SMILESCCNc1nc(NCCN(CC)CC)nc(OCC)n1
InChIInChI=1S/C13H26N6O/c1-5-14-11-16-12(18-13(17-11)20-8-4)15-9-10-19(6-2)7-3/h5-10H2,1-4H3,(H2,14,15,16,17,18)
InChIKeyWEIWGVLUJUWRAM-UHFFFAOYSA-N
MW282.39 g/mol
LogP1.46
Rot. Bonds10

About 2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine

2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine (PubChem CID 80770689) has the molecular formula C13H26N6O and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine
PubChem CID80770689
Molecular FormulaC13H26N6O
Molecular Weight282.39 g/mol
Exact Mass282.22
IUPAC Name2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine
SMILESCCNc1nc(NCCN(CC)CC)nc(OCC)n1
InChIInChI=1S/C13H26N6O/c1-5-14-11-16-12(18-13(17-11)20-8-4)15-9-10-19(6-2)7-3/h5-10H2,1-4H3,(H2,14,15,16,17,18)
InChIKeyWEIWGVLUJUWRAM-UHFFFAOYSA-N
XLogP1.46
TPSA75.20 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-N-[2-(dimethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine
CID 80770464
6-chloro-2-N-[2-(diethylamino)ethyl]-4-N-ethyl-1,3,5-triazine-2,4-diamine
CID 80769439
2-N-[2-[cyclopropyl(methyl)amino]ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine
CID 80823002
6-ethoxy-2-N-[2-[ethyl(methyl)amino]ethyl]-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80832327
3-[[4-ethoxy-6-(ethylamino)-1,3,5-triazin-2-yl]amino]propan-1-ol
CID 80773244
2-N-[2-(dimethylamino)ethyl]-6-ethoxy-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80770559
6-ethoxy-2-N,4-N-dipropyl-1,3,5-triazine-2,4-diamine
CID 80765702
2-[2-(diethylamino)ethoxy]-4-[2-[2-[[4-[2-(diethylamino)ethoxy]-6-[2-(diethylamino)ethylamino]-1,3,5-triazin-2-yl]amino]ethylsulfamoylsulfonylamino]ethylamino]-6-[2-(diethylamino)ethylamino]-1,3,5-triazine
CID 121339686
N-[2-[[4-ethoxy-6-(ethylamino)-1,3,5-triazin-2-yl]amino]ethyl]acetamide
CID 80788350
6-ethoxy-4-N-ethyl-2-N-(4,4,4-trifluorobutyl)-1,3,5-triazine-2,4-diamine
CID 115523140
6-ethoxy-4-N-ethyl-2-N-[2-(trifluoromethylsulfanyl)ethyl]-1,3,5-triazine-2,4-diamine
CID 106434023
6-ethoxy-4-N-ethyl-2-N-(2-imidazol-1-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80809601

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine (CID 80770689) is 2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine is CCNc1nc(NCCN(CC)CC)nc(OCC)n1.
What is the InChIKey of 2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is WEIWGVLUJUWRAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N6O/c1-5-14-11-16-12(18-13(17-11)20-8-4)15-9-10-19(6-2)7-3/h5-10H2,1-4H3,(H2,14,15,16,17,18).
What are the key properties of 2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine?
2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 282.39 g/mol, XLogP of 1.46, 10 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-(diethylamino)ethyl]-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80770689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).