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

C10H18N6O2 — CID 80777869

IUPAC6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine
SMILESCOc1nc(N)nc(NCCN2CCOCC2)n1
InChIInChI=1S/C10H18N6O2/c1-17-10-14-8(11)13-9(15-10)12-2-3-16-4-6-18-7-5-16/h2-7H2,1H3,(H3,11,12,13,14,15)
InChIKeyAVLDRZFEFLYQFP-UHFFFAOYSA-N
MW254.29 g/mol
LogP-0.79
Rot. Bonds5

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

6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine (PubChem CID 80777869) has the molecular formula C10H18N6O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine
PubChem CID80777869
Molecular FormulaC10H18N6O2
Molecular Weight254.29 g/mol
Exact Mass254.15
IUPAC Name6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine
SMILESCOc1nc(N)nc(NCCN2CCOCC2)n1
InChIInChI=1S/C10H18N6O2/c1-17-10-14-8(11)13-9(15-10)12-2-3-16-4-6-18-7-5-16/h2-7H2,1H3,(H3,11,12,13,14,15)
InChIKeyAVLDRZFEFLYQFP-UHFFFAOYSA-N
XLogP-0.79
TPSA98.42 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine (CID 80777869) is 6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine is COc1nc(N)nc(NCCN2CCOCC2)n1.
What is the InChIKey of 6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is AVLDRZFEFLYQFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6O2/c1-17-10-14-8(11)13-9(15-10)12-2-3-16-4-6-18-7-5-16/h2-7H2,1H3,(H3,11,12,13,14,15).
What are the key properties of 6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 254.29 g/mol, XLogP of -0.79, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80777869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).