1,2,3-tris(2-methoxypropyl)triazinane

C15H33N3O3 — CID 154133094

IUPAC1,2,3-tris(2-methoxypropyl)triazinane
SMILESCOC(C)CN1CCCN(CC(C)OC)N1CC(C)OC
InChIInChI=1S/C15H33N3O3/c1-13(19-4)10-16-8-7-9-17(11-14(2)20-5)18(16)12-15(3)21-6/h13-15H,7-12H2,1-6H3
InChIKeyOOQFRSKWCDFECA-UHFFFAOYSA-N
MW303.45 g/mol
LogP1.23
Rot. Bonds9

About 1,2,3-tris(2-methoxypropyl)triazinane

1,2,3-tris(2-methoxypropyl)triazinane (PubChem CID 154133094) has the molecular formula C15H33N3O3 and a molecular weight of 303.45 g/mol. Its IUPAC name is 1,2,3-tris(2-methoxypropyl)triazinane.

Molecular Properties

Compound Name1,2,3-tris(2-methoxypropyl)triazinane
PubChem CID154133094
Molecular FormulaC15H33N3O3
Molecular Weight303.45 g/mol
Exact Mass303.25
IUPAC Name1,2,3-tris(2-methoxypropyl)triazinane
SMILESCOC(C)CN1CCCN(CC(C)OC)N1CC(C)OC
InChIInChI=1S/C15H33N3O3/c1-13(19-4)10-16-8-7-9-17(11-14(2)20-5)18(16)12-15(3)21-6/h13-15H,7-12H2,1-6H3
InChIKeyOOQFRSKWCDFECA-UHFFFAOYSA-N
XLogP1.23
TPSA37.41 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-N-propylmorpholin-4-amine
CID 17904942
N,N-dimethyl-1-(4-methylmorpholin-2-yl)methanamine
CID 18728233
3-(2,6-dimethylmorpholin-4-yl)-N,N-dimethylpropan-1-amine
CID 19738302
N-[2-(1-morpholin-4-ylpropan-2-yloxy)ethyl]-N-propylpropan-1-amine
CID 19822683
2,6-Dimethyl-4-morpholin-4-ylmorpholine
CID 56628972
N-ethyl-N-propylmorpholin-4-amine
CID 57201743
N,N-dimethyl-1-[(2R)-4-methylmorpholin-2-yl]methanamine
CID 57960083
1-[2,3-Bis(2-hydroxypropyl)triazinan-1-yl]propan-2-ol
CID 67198229
2,6-Dimethyl-4-(2-methylmorpholin-4-yl)morpholine
CID 68148188
Trimethyl-[[4-(2-propoxyethyl)morpholin-2-yl]methyl]azanium
CID 68248281
1-(4-ethylmorpholin-2-yl)-N,N-dimethylmethanamine
CID 68250361
N,N-dipropylmorpholin-4-amine
CID 69162216

Frequently Asked Questions

What is the IUPAC name of 1,2,3-tris(2-methoxypropyl)triazinane?
The IUPAC name of 1,2,3-tris(2-methoxypropyl)triazinane (CID 154133094) is 1,2,3-tris(2-methoxypropyl)triazinane.
What is the SMILES notation for 1,2,3-tris(2-methoxypropyl)triazinane?
The canonical SMILES for 1,2,3-tris(2-methoxypropyl)triazinane is COC(C)CN1CCCN(CC(C)OC)N1CC(C)OC.
What is the InChIKey of 1,2,3-tris(2-methoxypropyl)triazinane?
The InChIKey is OOQFRSKWCDFECA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3O3/c1-13(19-4)10-16-8-7-9-17(11-14(2)20-5)18(16)12-15(3)21-6/h13-15H,7-12H2,1-6H3.
What are the key properties of 1,2,3-tris(2-methoxypropyl)triazinane?
1,2,3-tris(2-methoxypropyl)triazinane has a molecular weight of 303.45 g/mol, XLogP of 1.23, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3-tris(2-methoxypropyl)triazinane is sourced from PubChem (CID 154133094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).