4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine

C17H28N6O2 — CID 683320

IUPAC4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine
SMILESCC1CCN(c2nc(N3CCOCC3)nc(N3CCOCC3)n2)CC1
InChIInChI=1S/C17H28N6O2/c1-14-2-4-21(5-3-14)15-18-16(22-6-10-24-11-7-22)20-17(19-15)23-8-12-25-13-9-23/h14H,2-13H2,1H3
InChIKeyWDRJGNFWEYEOCI-UHFFFAOYSA-N
MW348.45 g/mol
LogP0.78
Rot. Bonds3

About 4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine

4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine (PubChem CID 683320) has the molecular formula C17H28N6O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine
PubChem CID683320
Molecular FormulaC17H28N6O2
Molecular Weight348.45 g/mol
Exact Mass348.23
IUPAC Name4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine
SMILESCC1CCN(c2nc(N3CCOCC3)nc(N3CCOCC3)n2)CC1
InChIInChI=1S/C17H28N6O2/c1-14-2-4-21(5-3-14)15-18-16(22-6-10-24-11-7-22)20-17(19-15)23-8-12-25-13-9-23/h14H,2-13H2,1H3
InChIKeyWDRJGNFWEYEOCI-UHFFFAOYSA-N
XLogP0.78
TPSA66.85 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine?
The IUPAC name of 4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine (CID 683320) is 4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine.
What is the SMILES notation for 4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine?
The canonical SMILES for 4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine is CC1CCN(c2nc(N3CCOCC3)nc(N3CCOCC3)n2)CC1.
What is the InChIKey of 4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine?
The InChIKey is WDRJGNFWEYEOCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N6O2/c1-14-2-4-21(5-3-14)15-18-16(22-6-10-24-11-7-22)20-17(19-15)23-8-12-25-13-9-23/h14H,2-13H2,1H3.
What are the key properties of 4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine?
4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine has a molecular weight of 348.45 g/mol, XLogP of 0.78, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-methylpiperidin-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine is sourced from PubChem (CID 683320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).