4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine

C15H19N5O — CID 80751669

IUPAC4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCC(C)Oc1nc(N)nc(N2CCCc3ccccc32)n1
InChIInChI=1S/C15H19N5O/c1-10(2)21-15-18-13(16)17-14(19-15)20-9-5-7-11-6-3-4-8-12(11)20/h3-4,6,8,10H,5,7,9H2,1-2H3,(H2,16,17,18,19)
InChIKeyUBEPTRBZRMYQKJ-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.33
Rot. Bonds3

About 4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine

4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine (PubChem CID 80751669) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
PubChem CID80751669
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCC(C)Oc1nc(N)nc(N2CCCc3ccccc32)n1
InChIInChI=1S/C15H19N5O/c1-10(2)21-15-18-13(16)17-14(19-15)20-9-5-7-11-6-3-4-8-12(11)20/h3-4,6,8,10H,5,7,9H2,1-2H3,(H2,16,17,18,19)
InChIKeyUBEPTRBZRMYQKJ-UHFFFAOYSA-N
XLogP2.33
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine (CID 80751669) is 4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine is CC(C)Oc1nc(N)nc(N2CCCc3ccccc32)n1.
What is the InChIKey of 4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The InChIKey is UBEPTRBZRMYQKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-10(2)21-15-18-13(16)17-14(19-15)20-9-5-7-11-6-3-4-8-12(11)20/h3-4,6,8,10H,5,7,9H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine has a molecular weight of 285.35 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dihydro-2H-quinolin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80751669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).