4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine

C13H15N5O — CID 63868760

IUPAC4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine
SMILESNc1nc(-c2ccccc2)nc(N2CCOCC2)n1
InChIInChI=1S/C13H15N5O/c14-12-15-11(10-4-2-1-3-5-10)16-13(17-12)18-6-8-19-9-7-18/h1-5H,6-9H2,(H2,14,15,16,17)
InChIKeyANHFZHAAXDXQFL-UHFFFAOYSA-N
MW257.30 g/mol
LogP0.96
Rot. Bonds2

About 4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine

4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine (PubChem CID 63868760) has the molecular formula C13H15N5O and a molecular weight of 257.30 g/mol. Its IUPAC name is 4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine
PubChem CID63868760
Molecular FormulaC13H15N5O
Molecular Weight257.30 g/mol
Exact Mass257.13
IUPAC Name4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine
SMILESNc1nc(-c2ccccc2)nc(N2CCOCC2)n1
InChIInChI=1S/C13H15N5O/c14-12-15-11(10-4-2-1-3-5-10)16-13(17-12)18-6-8-19-9-7-18/h1-5H,6-9H2,(H2,14,15,16,17)
InChIKeyANHFZHAAXDXQFL-UHFFFAOYSA-N
XLogP0.96
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine (CID 63868760) is 4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine is Nc1nc(-c2ccccc2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine?
The InChIKey is ANHFZHAAXDXQFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O/c14-12-15-11(10-4-2-1-3-5-10)16-13(17-12)18-6-8-19-9-7-18/h1-5H,6-9H2,(H2,14,15,16,17).
What are the key properties of 4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine?
4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine has a molecular weight of 257.30 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-6-phenyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 63868760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).