6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine

C14H26N6O2 — CID 767097

IUPAC6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
SMILESCCOc1nc(NCCN2CCOCC2)nc(NC(C)C)n1
InChIInChI=1S/C14H26N6O2/c1-4-22-14-18-12(17-13(19-14)16-11(2)3)15-5-6-20-7-9-21-10-8-20/h11H,4-10H2,1-3H3,(H2,15,16,17,18,19)
InChIKeyQFMNRYAEUDKHEI-UHFFFAOYSA-N
MW310.40 g/mol
LogP0.83
Rot. Bonds8

About 6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine

6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine (PubChem CID 767097) has the molecular formula C14H26N6O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
PubChem CID767097
Molecular FormulaC14H26N6O2
Molecular Weight310.40 g/mol
Exact Mass310.21
IUPAC Name6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
SMILESCCOc1nc(NCCN2CCOCC2)nc(NC(C)C)n1
InChIInChI=1S/C14H26N6O2/c1-4-22-14-18-12(17-13(19-14)16-11(2)3)15-5-6-20-7-9-21-10-8-20/h11H,4-10H2,1-3H3,(H2,15,16,17,18,19)
InChIKeyQFMNRYAEUDKHEI-UHFFFAOYSA-N
XLogP0.83
TPSA84.43 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine (CID 767097) is 6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine is CCOc1nc(NCCN2CCOCC2)nc(NC(C)C)n1.
What is the InChIKey of 6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is QFMNRYAEUDKHEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6O2/c1-4-22-14-18-12(17-13(19-14)16-11(2)3)15-5-6-20-7-9-21-10-8-20/h11H,4-10H2,1-3H3,(H2,15,16,17,18,19).
What are the key properties of 6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine?
6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 310.40 g/mol, XLogP of 0.83, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 767097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).