4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane

C13H26N2 — CID 177340747

IUPAC4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane
SMILESC=C1NC(CC)(CCC)CCN1CCC
InChIInChI=1S/C13H26N2/c1-5-8-13(7-3)9-11-15(10-6-2)12(4)14-13/h14H,4-11H2,1-3H3
InChIKeyGZAKLVMKWNXQEA-UHFFFAOYSA-N
MW210.36 g/mol
LogP3.11
Rot. Bonds5

About 4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane

4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane (PubChem CID 177340747) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane.

Molecular Properties

Compound Name4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane
PubChem CID177340747
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane
SMILESC=C1NC(CC)(CCC)CCN1CCC
InChIInChI=1S/C13H26N2/c1-5-8-13(7-3)9-11-15(10-6-2)12(4)14-13/h14H,4-11H2,1-3H3
InChIKeyGZAKLVMKWNXQEA-UHFFFAOYSA-N
XLogP3.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane?
The IUPAC name of 4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane (CID 177340747) is 4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane.
What is the SMILES notation for 4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane?
The canonical SMILES for 4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane is C=C1NC(CC)(CCC)CCN1CCC.
What is the InChIKey of 4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane?
The InChIKey is GZAKLVMKWNXQEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-5-8-13(7-3)9-11-15(10-6-2)12(4)14-13/h14H,4-11H2,1-3H3.
What are the key properties of 4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane?
4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane has a molecular weight of 210.36 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-methylidene-1,4-dipropyl-1,3-diazinane is sourced from PubChem (CID 177340747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).