6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine

C11H20N6O2 — CID 80777051

IUPAC6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(NCCN2CCOCC2)nc(OC)n1
InChIInChI=1S/C11H20N6O2/c1-12-9-14-10(16-11(15-9)18-2)13-3-4-17-5-7-19-8-6-17/h3-8H2,1-2H3,(H2,12,13,14,15,16)
InChIKeyDSOUJALCVRBDIS-UHFFFAOYSA-N
MW268.32 g/mol
LogP-0.33
Rot. Bonds6

About 6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine

6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine (PubChem CID 80777051) has the molecular formula C11H20N6O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine
PubChem CID80777051
Molecular FormulaC11H20N6O2
Molecular Weight268.32 g/mol
Exact Mass268.16
IUPAC Name6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(NCCN2CCOCC2)nc(OC)n1
InChIInChI=1S/C11H20N6O2/c1-12-9-14-10(16-11(15-9)18-2)13-3-4-17-5-7-19-8-6-17/h3-8H2,1-2H3,(H2,12,13,14,15,16)
InChIKeyDSOUJALCVRBDIS-UHFFFAOYSA-N
XLogP-0.33
TPSA84.43 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine (CID 80777051) is 6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine is CNc1nc(NCCN2CCOCC2)nc(OC)n1.
What is the InChIKey of 6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is DSOUJALCVRBDIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O2/c1-12-9-14-10(16-11(15-9)18-2)13-3-4-17-5-7-19-8-6-17/h3-8H2,1-2H3,(H2,12,13,14,15,16).
What are the key properties of 6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 268.32 g/mol, XLogP of -0.33, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80777051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).