4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine

C14H24N4O2 — CID 80877748

IUPAC4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(N)nc(OC2CC(C)CC(C)C2)n1
InChIInChI=1S/C14H24N4O2/c1-4-5-19-13-16-12(15)17-14(18-13)20-11-7-9(2)6-10(3)8-11/h9-11H,4-8H2,1-3H3,(H2,15,16,17,18)
InChIKeyKXHBLYOSLYYSEU-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.45
Rot. Bonds5

About 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine

4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine (PubChem CID 80877748) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine
PubChem CID80877748
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(N)nc(OC2CC(C)CC(C)C2)n1
InChIInChI=1S/C14H24N4O2/c1-4-5-19-13-16-12(15)17-14(18-13)20-11-7-9(2)6-10(3)8-11/h9-11H,4-8H2,1-3H3,(H2,15,16,17,18)
InChIKeyKXHBLYOSLYYSEU-UHFFFAOYSA-N
XLogP2.45
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine with MolForge

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Related Compounds

[4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80925332
4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine
CID 80872035
4-ethoxy-6-(3-methylcyclohexyl)oxy-1,3,5-triazin-2-amine
CID 80861927
2-N-(3-methylcyclopentyl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 114542042
4-(3,5-dimethylcyclohexyl)oxy-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine
CID 80871614
4-(3-methylbutoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 80858156
2-N-[(4-methylcyclohexyl)methyl]-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80827677
4-but-3-ynoxy-6-propoxy-1,3,5-triazin-2-amine
CID 106795654
(4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine
CID 80909474
6-propoxy-2-N,2-N-dipropyl-1,3,5-triazine-2,4-diamine
CID 80763865
2-N-butan-2-yl-2-N-methyl-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80775578
4-[2-(2-methylpropoxy)ethoxy]-6-propoxy-1,3,5-triazin-2-amine
CID 106451498

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine (CID 80877748) is 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine is CCCOc1nc(N)nc(OC2CC(C)CC(C)C2)n1.
What is the InChIKey of 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine?
The InChIKey is KXHBLYOSLYYSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-4-5-19-13-16-12(15)17-14(18-13)20-11-7-9(2)6-10(3)8-11/h9-11H,4-8H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine?
4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine has a molecular weight of 280.37 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80877748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).