3-ethyl-1,2,3-trimethyldiazinane

C9H20N2 — CID 178101796

IUPAC3-ethyl-1,2,3-trimethyldiazinane
SMILESCCC1(C)CCCN(C)N1C
InChIInChI=1S/C9H20N2/c1-5-9(2)7-6-8-10(3)11(9)4/h5-8H2,1-4H3
InChIKeyRACPHYRRPQAUAB-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.73
Rot. Bonds1

About 3-ethyl-1,2,3-trimethyldiazinane

3-ethyl-1,2,3-trimethyldiazinane (PubChem CID 178101796) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 3-ethyl-1,2,3-trimethyldiazinane.

Molecular Properties

Compound Name3-ethyl-1,2,3-trimethyldiazinane
PubChem CID178101796
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name3-ethyl-1,2,3-trimethyldiazinane
SMILESCCC1(C)CCCN(C)N1C
InChIInChI=1S/C9H20N2/c1-5-9(2)7-6-8-10(3)11(9)4/h5-8H2,1-4H3
InChIKeyRACPHYRRPQAUAB-UHFFFAOYSA-N
XLogP1.73
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1,2,3-trimethyldiazinane?
The IUPAC name of 3-ethyl-1,2,3-trimethyldiazinane (CID 178101796) is 3-ethyl-1,2,3-trimethyldiazinane.
What is the SMILES notation for 3-ethyl-1,2,3-trimethyldiazinane?
The canonical SMILES for 3-ethyl-1,2,3-trimethyldiazinane is CCC1(C)CCCN(C)N1C.
What is the InChIKey of 3-ethyl-1,2,3-trimethyldiazinane?
The InChIKey is RACPHYRRPQAUAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-5-9(2)7-6-8-10(3)11(9)4/h5-8H2,1-4H3.
What are the key properties of 3-ethyl-1,2,3-trimethyldiazinane?
3-ethyl-1,2,3-trimethyldiazinane has a molecular weight of 156.27 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1,2,3-trimethyldiazinane is sourced from PubChem (CID 178101796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).