N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine

C13H20N6O2 — CID 116806108

IUPACN-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCCNc1nc(Oc2cnn(CC)c2)nc(OC(C)C)n1
InChIInChI=1S/C13H20N6O2/c1-5-14-11-16-12(20-9(3)4)18-13(17-11)21-10-7-15-19(6-2)8-10/h7-9H,5-6H2,1-4H3,(H,14,16,17,18)
InChIKeyASUVYQKQOOVFHA-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.10
Rot. Bonds7

About N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine

N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine (PubChem CID 116806108) has the molecular formula C13H20N6O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine
PubChem CID116806108
Molecular FormulaC13H20N6O2
Molecular Weight292.34 g/mol
Exact Mass292.16
IUPAC NameN-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCCNc1nc(Oc2cnn(CC)c2)nc(OC(C)C)n1
InChIInChI=1S/C13H20N6O2/c1-5-14-11-16-12(20-9(3)4)18-13(17-11)21-10-7-15-19(6-2)8-10/h7-9H,5-6H2,1-4H3,(H,14,16,17,18)
InChIKeyASUVYQKQOOVFHA-UHFFFAOYSA-N
XLogP2.10
TPSA86.98 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine with MolForge

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Related Compounds

[4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
CID 116806768
[4-(1-ethylpyrazol-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 116806821
5-chloro-N-ethyl-4-(1-ethylpyrazol-4-yl)oxypyrimidin-2-amine
CID 116806063
N-ethyl-4-(2-iodophenoxy)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80874891
4-N-ethyl-6-propan-2-yloxy-2-N-(2,3,3-trimethylbutyl)-1,3,5-triazine-2,4-diamine
CID 83145978
2-N-(2,3-dimethylbutyl)-4-N-ethyl-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80844599
N-[[2-(1-ethylpyrazol-4-yl)oxypyrimidin-5-yl]methyl]-2-methylpropan-2-amine
CID 116802125
N-ethyl-4-(1,3-oxazol-2-ylsulfanyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 106928369
N-methyl-4-propoxy-6-(1-propylpyrazol-4-yl)oxy-1,3,5-triazin-2-amine
CID 116806261
3-[[4-(ethylamino)-6-propan-2-yloxy-1,3,5-triazin-2-yl]amino]-2,3-dimethylbutan-2-ol
CID 106198621
4-N-ethyl-2-N-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80814989
4-but-3-enoxy-N-ethyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80862211

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The IUPAC name of N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine (CID 116806108) is N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine is CCNc1nc(Oc2cnn(CC)c2)nc(OC(C)C)n1.
What is the InChIKey of N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The InChIKey is ASUVYQKQOOVFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6O2/c1-5-14-11-16-12(20-9(3)4)18-13(17-11)21-10-7-15-19(6-2)8-10/h7-9H,5-6H2,1-4H3,(H,14,16,17,18).
What are the key properties of N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine?
N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine has a molecular weight of 292.34 g/mol, XLogP of 2.10, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 116806108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).