4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine

C13H24N4O3 — CID 80861104

IUPAC4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine
SMILESCCCCOCCOc1nc(NCC)nc(OCC)n1
InChIInChI=1S/C13H24N4O3/c1-4-7-8-18-9-10-20-13-16-11(14-5-2)15-12(17-13)19-6-3/h4-10H2,1-3H3,(H,14,15,16,17)
InChIKeyAWMJUGQXYQVEPQ-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.90
Rot. Bonds11

About 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine

4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine (PubChem CID 80861104) has the molecular formula C13H24N4O3 and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine
PubChem CID80861104
Molecular FormulaC13H24N4O3
Molecular Weight284.36 g/mol
Exact Mass284.18
IUPAC Name4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine
SMILESCCCCOCCOc1nc(NCC)nc(OCC)n1
InChIInChI=1S/C13H24N4O3/c1-4-7-8-18-9-10-20-13-16-11(14-5-2)15-12(17-13)19-6-3/h4-10H2,1-3H3,(H,14,15,16,17)
InChIKeyAWMJUGQXYQVEPQ-UHFFFAOYSA-N
XLogP1.90
TPSA78.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine 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

4-ethoxy-6-(2-propoxyethoxy)-N-propyl-1,3,5-triazin-2-amine
CID 80876867
2-N,4-N-diethyl-6-octadecoxy-1,3,5-triazine-2,4-diamine
CID 146196905
2-N,4-N-diethyl-6-hexadecoxy-1,3,5-triazine-2,4-diamine
CID 3103369
4-ethoxy-N-ethyl-6-(3-methylbutoxy)-1,3,5-triazin-2-amine
CID 80859393
4-(3,3-dimethylbutoxy)-N-ethyl-6-propoxy-1,3,5-triazin-2-amine
CID 80877652
2-N-(2-ethoxy-2-methylpropyl)-4-N-ethyl-6-propoxy-1,3,5-triazine-2,4-diamine
CID 114944769
4-chloro-N-ethyl-6-octoxy-1,3,5-triazin-2-amine
CID 80862197
N-ethyl-4-(4-methylpentoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 80861519
4-ethoxy-6-hydrazinyl-N-(3-propoxypropyl)-1,3,5-triazin-2-amine
CID 82947451
5-bromo-4-(2-butoxyethoxy)-N-ethylpyrimidin-2-amine
CID 80861009
3-[[4-ethoxy-6-(ethylamino)-1,3,5-triazin-2-yl]amino]propan-1-ol
CID 80773244
4-ethoxy-N-ethyl-6-(4-methylphenoxy)-1,3,5-triazin-2-amine
CID 80863510

Frequently Asked Questions

What is the IUPAC name of 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine (CID 80861104) is 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine is CCCCOCCOc1nc(NCC)nc(OCC)n1.
What is the InChIKey of 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine?
The InChIKey is AWMJUGQXYQVEPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O3/c1-4-7-8-18-9-10-20-13-16-11(14-5-2)15-12(17-13)19-6-3/h4-10H2,1-3H3,(H,14,15,16,17).
What are the key properties of 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine?
4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine has a molecular weight of 284.36 g/mol, XLogP of 1.90, 11 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-butoxyethoxy)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80861104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).