2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

C8H14N6O — CID 80770087

IUPAC2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N)nc(N2CCOCC2)n1
InChIInChI=1S/C8H14N6O/c1-10-7-11-6(9)12-8(13-7)14-2-4-15-5-3-14/h2-5H2,1H3,(H3,9,10,11,12,13)
InChIKeyIXPULUNLCODHPL-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.67
Rot. Bonds2

About 2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine (PubChem CID 80770087) has the molecular formula C8H14N6O and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
PubChem CID80770087
Molecular FormulaC8H14N6O
Molecular Weight210.24 g/mol
Exact Mass210.12
IUPAC Name2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N)nc(N2CCOCC2)n1
InChIInChI=1S/C8H14N6O/c1-10-7-11-6(9)12-8(13-7)14-2-4-15-5-3-14/h2-5H2,1H3,(H3,9,10,11,12,13)
InChIKeyIXPULUNLCODHPL-UHFFFAOYSA-N
XLogP-0.67
TPSA89.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine (CID 80770087) is 2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is CNc1nc(N)nc(N2CCOCC2)n1.
What is the InChIKey of 2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is IXPULUNLCODHPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N6O/c1-10-7-11-6(9)12-8(13-7)14-2-4-15-5-3-14/h2-5H2,1H3,(H3,9,10,11,12,13).
What are the key properties of 2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 210.24 g/mol, XLogP of -0.67, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80770087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).