N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine

C11H20N4O2 — CID 80858244

IUPACN-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine
SMILESCCNc1nc(OC)nc(OCCC(C)C)n1
InChIInChI=1S/C11H20N4O2/c1-5-12-9-13-10(16-4)15-11(14-9)17-7-6-8(2)3/h8H,5-7H2,1-4H3,(H,12,13,14,15)
InChIKeyRESSCSDLKSRUTJ-UHFFFAOYSA-N
MW240.31 g/mol
LogP1.74
Rot. Bonds7

About N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine

N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine (PubChem CID 80858244) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine
PubChem CID80858244
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC NameN-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine
SMILESCCNc1nc(OC)nc(OCCC(C)C)n1
InChIInChI=1S/C11H20N4O2/c1-5-12-9-13-10(16-4)15-11(14-9)17-7-6-8(2)3/h8H,5-7H2,1-4H3,(H,12,13,14,15)
InChIKeyRESSCSDLKSRUTJ-UHFFFAOYSA-N
XLogP1.74
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-ethoxy-N-ethyl-6-(3-methylbutoxy)-1,3,5-triazin-2-amine
CID 80859393
N-ethyl-4-(4-methylpentoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 80861519
4-[2-(dimethylamino)ethoxy]-N-ethyl-6-methoxy-1,3,5-triazin-2-amine
CID 80871890
3-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]oxy]propan-1-ol
CID 80866003
N-ethyl-4-methoxy-6-(3-methoxy-3-methylbutoxy)-1,3,5-triazin-2-amine
CID 106669087
N-ethyl-4-methoxy-6-prop-2-enoxy-1,3,5-triazin-2-amine
CID 80868544
4-N-ethyl-2-N-(5-methylhexan-2-yl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80819620
[4-(3-methylbutoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80909820
N-ethyl-4-(3-methylbutoxy)-6-(1,2,4-triazol-1-yl)-1,3,5-triazin-2-amine
CID 80858159
N-ethyl-4-methoxy-6-(2-thiophen-2-ylethoxy)-1,3,5-triazin-2-amine
CID 80873852
N-ethyl-4-methoxy-6-octan-2-yloxy-1,3,5-triazin-2-amine
CID 80861953
1-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]-2-methylpropan-2-ol
CID 80841768

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine?
The IUPAC name of N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine (CID 80858244) is N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine.
What is the SMILES notation for N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine?
The canonical SMILES for N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine is CCNc1nc(OC)nc(OCCC(C)C)n1.
What is the InChIKey of N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine?
The InChIKey is RESSCSDLKSRUTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-5-12-9-13-10(16-4)15-11(14-9)17-7-6-8(2)3/h8H,5-7H2,1-4H3,(H,12,13,14,15).
What are the key properties of N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine?
N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine has a molecular weight of 240.31 g/mol, XLogP of 1.74, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methoxy-6-(3-methylbutoxy)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80858244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).