4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine

C15H15N5O — CID 81230923

IUPAC4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine
SMILESCNc1nc(OC)nc(-c2ccc3nc(C)ccc3c2)n1
InChIInChI=1S/C15H15N5O/c1-9-4-5-10-8-11(6-7-12(10)17-9)13-18-14(16-2)20-15(19-13)21-3/h4-8H,1-3H3,(H,16,18,19,20)
InChIKeyBLRULGMPGOSZOA-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.45
Rot. Bonds3

About 4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine

4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine (PubChem CID 81230923) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is 4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine
PubChem CID81230923
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine
SMILESCNc1nc(OC)nc(-c2ccc3nc(C)ccc3c2)n1
InChIInChI=1S/C15H15N5O/c1-9-4-5-10-8-11(6-7-12(10)17-9)13-18-14(16-2)20-15(19-13)21-3/h4-8H,1-3H3,(H,16,18,19,20)
InChIKeyBLRULGMPGOSZOA-UHFFFAOYSA-N
XLogP2.45
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine (CID 81230923) is 4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine is CNc1nc(OC)nc(-c2ccc3nc(C)ccc3c2)n1.
What is the InChIKey of 4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine?
The InChIKey is BLRULGMPGOSZOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-9-4-5-10-8-11(6-7-12(10)17-9)13-18-14(16-2)20-15(19-13)21-3/h4-8H,1-3H3,(H,16,18,19,20).
What are the key properties of 4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine?
4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine has a molecular weight of 281.32 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-methyl-6-(2-methylquinolin-6-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 81230923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).