1-ethoxy-3,5-dimethyl-1,3,5-triazinane

C7H17N3O — CID 89352923

IUPAC1-ethoxy-3,5-dimethyl-1,3,5-triazinane
SMILESCCON1CN(C)CN(C)C1
InChIInChI=1S/C7H17N3O/c1-4-11-10-6-8(2)5-9(3)7-10/h4-7H2,1-3H3
InChIKeyYUYSRZBERVMLOL-UHFFFAOYSA-N
MW159.23 g/mol
LogP-0.01
Rot. Bonds2

About 1-ethoxy-3,5-dimethyl-1,3,5-triazinane

1-ethoxy-3,5-dimethyl-1,3,5-triazinane (PubChem CID 89352923) has the molecular formula C7H17N3O and a molecular weight of 159.23 g/mol. Its IUPAC name is 1-ethoxy-3,5-dimethyl-1,3,5-triazinane.

Molecular Properties

Compound Name1-ethoxy-3,5-dimethyl-1,3,5-triazinane
PubChem CID89352923
Molecular FormulaC7H17N3O
Molecular Weight159.23 g/mol
Exact Mass159.14
IUPAC Name1-ethoxy-3,5-dimethyl-1,3,5-triazinane
SMILESCCON1CN(C)CN(C)C1
InChIInChI=1S/C7H17N3O/c1-4-11-10-6-8(2)5-9(3)7-10/h4-7H2,1-3H3
InChIKeyYUYSRZBERVMLOL-UHFFFAOYSA-N
XLogP-0.01
TPSA18.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 5-0.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethoxythiomorpholine
CID 69240675
1-ethoxy-4-propan-2-ylpiperazine
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trichlorochromium(1+);1,3,5-trimethyl-1,3,5-triazinane
CID 87195451
benzene;1,3-dimethyl-1,3-diazetidine;ethane
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3,5-dimethyl-1,3,5-triazinan-1-amine
CID 141002820
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CID 175823545
sodium;2-(4-ethoxypiperazin-1-yl)ethanesulfonic acid;hydride
CID 174954120
methoxyethane;1-methylpyrrolidine
CID 90838943
diethoxysilane;1-methylaziridine
CID 173126406
methane;methyl-[[methyl(methylazanidylmethyl)amino]methyl]azanide;rhenium;1,3,5-trimethyl-1,3,5-triazinane
CID 157112294
1,3,5-trimethyl-1,3,5-triazecane
CID 154027653

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-3,5-dimethyl-1,3,5-triazinane?
The IUPAC name of 1-ethoxy-3,5-dimethyl-1,3,5-triazinane (CID 89352923) is 1-ethoxy-3,5-dimethyl-1,3,5-triazinane.
What is the SMILES notation for 1-ethoxy-3,5-dimethyl-1,3,5-triazinane?
The canonical SMILES for 1-ethoxy-3,5-dimethyl-1,3,5-triazinane is CCON1CN(C)CN(C)C1.
What is the InChIKey of 1-ethoxy-3,5-dimethyl-1,3,5-triazinane?
The InChIKey is YUYSRZBERVMLOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O/c1-4-11-10-6-8(2)5-9(3)7-10/h4-7H2,1-3H3.
What are the key properties of 1-ethoxy-3,5-dimethyl-1,3,5-triazinane?
1-ethoxy-3,5-dimethyl-1,3,5-triazinane has a molecular weight of 159.23 g/mol, XLogP of -0.01, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-3,5-dimethyl-1,3,5-triazinane is sourced from PubChem (CID 89352923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).