4-ethyl-6-methyl-1,3-diazinane

C7H16N2 — CID 146883415

IUPAC4-ethyl-6-methyl-1,3-diazinane
SMILESCCC1CC(C)NCN1
InChIInChI=1S/C7H16N2/c1-3-7-4-6(2)8-5-9-7/h6-9H,3-5H2,1-2H3
InChIKeySUOZUHBLDDLETD-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.69
Rot. Bonds1

About 4-ethyl-6-methyl-1,3-diazinane

4-ethyl-6-methyl-1,3-diazinane (PubChem CID 146883415) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 4-ethyl-6-methyl-1,3-diazinane.

Molecular Properties

Compound Name4-ethyl-6-methyl-1,3-diazinane
PubChem CID146883415
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name4-ethyl-6-methyl-1,3-diazinane
SMILESCCC1CC(C)NCN1
InChIInChI=1S/C7H16N2/c1-3-7-4-6(2)8-5-9-7/h6-9H,3-5H2,1-2H3
InChIKeySUOZUHBLDDLETD-UHFFFAOYSA-N
XLogP0.69
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-methyl-1,3-diazinane?
The IUPAC name of 4-ethyl-6-methyl-1,3-diazinane (CID 146883415) is 4-ethyl-6-methyl-1,3-diazinane.
What is the SMILES notation for 4-ethyl-6-methyl-1,3-diazinane?
The canonical SMILES for 4-ethyl-6-methyl-1,3-diazinane is CCC1CC(C)NCN1.
What is the InChIKey of 4-ethyl-6-methyl-1,3-diazinane?
The InChIKey is SUOZUHBLDDLETD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-3-7-4-6(2)8-5-9-7/h6-9H,3-5H2,1-2H3.
What are the key properties of 4-ethyl-6-methyl-1,3-diazinane?
4-ethyl-6-methyl-1,3-diazinane has a molecular weight of 128.22 g/mol, XLogP of 0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-methyl-1,3-diazinane is sourced from PubChem (CID 146883415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).