4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine

C10H18N4O — CID 106659288

IUPAC4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCCCCc1nc(N)nc(OC(C)C)n1
InChIInChI=1S/C10H18N4O/c1-4-5-6-8-12-9(11)14-10(13-8)15-7(2)3/h7H,4-6H2,1-3H3,(H2,11,12,13,14)
InChIKeyOVXZQYKHKLOITO-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.58
Rot. Bonds5

About 4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine

4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine (PubChem CID 106659288) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
PubChem CID106659288
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCCCCc1nc(N)nc(OC(C)C)n1
InChIInChI=1S/C10H18N4O/c1-4-5-6-8-12-9(11)14-10(13-8)15-7(2)3/h7H,4-6H2,1-3H3,(H2,11,12,13,14)
InChIKeyOVXZQYKHKLOITO-UHFFFAOYSA-N
XLogP1.58
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine (CID 106659288) is 4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine is CCCCc1nc(N)nc(OC(C)C)n1.
What is the InChIKey of 4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The InChIKey is OVXZQYKHKLOITO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-5-6-8-12-9(11)14-10(13-8)15-7(2)3/h7H,4-6H2,1-3H3,(H2,11,12,13,14).
What are the key properties of 4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine has a molecular weight of 210.28 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-6-propan-2-yloxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 106659288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).