4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine

C10H16N4O2 — CID 80872035

IUPAC4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(N)nc(OC2CCC2)n1
InChIInChI=1S/C10H16N4O2/c1-2-6-15-9-12-8(11)13-10(14-9)16-7-4-3-5-7/h7H,2-6H2,1H3,(H2,11,12,13,14)
InChIKeyXIUDVTDRAGDGLG-UHFFFAOYSA-N
MW224.26 g/mol
LogP1.17
Rot. Bonds5

About 4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine

4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine (PubChem CID 80872035) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine
PubChem CID80872035
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(N)nc(OC2CCC2)n1
InChIInChI=1S/C10H16N4O2/c1-2-6-15-9-12-8(11)13-10(14-9)16-7-4-3-5-7/h7H,2-6H2,1H3,(H2,11,12,13,14)
InChIKeyXIUDVTDRAGDGLG-UHFFFAOYSA-N
XLogP1.17
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine
CID 80877748
(4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine
CID 80909474
4-ethoxy-6-(3-methylcyclohexyl)oxy-1,3,5-triazin-2-amine
CID 80861927
[4-(3-methoxycyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80924501
4-cyclopentyloxy-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80861761
[4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80921167
4-(3-methylbutoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 80858156
4-but-3-ynoxy-6-propoxy-1,3,5-triazin-2-amine
CID 106795654
4-(2-methylpyrrolidin-1-yl)-6-propoxy-1,3,5-triazin-2-amine
CID 80791929
2-N-methyl-2-N-(2-methylcyclohexyl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80820928
[4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80925332
2-chloro-4-(oxolan-3-yloxy)-6-propoxy-1,3,5-triazine
CID 63557044

Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine (CID 80872035) is 4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine is CCCOc1nc(N)nc(OC2CCC2)n1.
What is the InChIKey of 4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine?
The InChIKey is XIUDVTDRAGDGLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-2-6-15-9-12-8(11)13-10(14-9)16-7-4-3-5-7/h7H,2-6H2,1H3,(H2,11,12,13,14).
What are the key properties of 4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine?
4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine has a molecular weight of 224.26 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80872035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).