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

C11H20N6O2 — CID 80765285

IUPAC2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(NCCOC)nc(N2CCOCC2)n1
InChIInChI=1S/C11H20N6O2/c1-12-9-14-10(13-3-6-18-2)16-11(15-9)17-4-7-19-8-5-17/h3-8H2,1-2H3,(H2,12,13,14,15,16)
InChIKeyFULQNNWMJDDYBK-UHFFFAOYSA-N
MW268.32 g/mol
LogP-0.19
Rot. Bonds6

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

2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine (PubChem CID 80765285) has the molecular formula C11H20N6O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
PubChem CID80765285
Molecular FormulaC11H20N6O2
Molecular Weight268.32 g/mol
Exact Mass268.16
IUPAC Name2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(NCCOC)nc(N2CCOCC2)n1
InChIInChI=1S/C11H20N6O2/c1-12-9-14-10(13-3-6-18-2)16-11(15-9)17-4-7-19-8-5-17/h3-8H2,1-2H3,(H2,12,13,14,15,16)
InChIKeyFULQNNWMJDDYBK-UHFFFAOYSA-N
XLogP-0.19
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 ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine (CID 80765285) is 2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is CNc1nc(NCCOC)nc(N2CCOCC2)n1.
What is the InChIKey of 2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is FULQNNWMJDDYBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O2/c1-12-9-14-10(13-3-6-18-2)16-11(15-9)17-4-7-19-8-5-17/h3-8H2,1-2H3,(H2,12,13,14,15,16).
What are the key properties of 2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 268.32 g/mol, XLogP of -0.19, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80765285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).