(3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane

C14H24N2 — CID 142941810

IUPAC(3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane
SMILESC/C=C1\C/C(=C\CC)NCC12CCNCC2
InChIInChI=1S/C14H24N2/c1-3-5-13-10-12(4-2)14(11-16-13)6-8-15-9-7-14/h4-5,15-16H,3,6-11H2,1-2H3/b12-4+,13-5+
InChIKeyWYAUOQSVDGUYLB-QGVJZHQLSA-N
MW220.36 g/mol
LogP2.59
Rot. Bonds1

About (3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane

(3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane (PubChem CID 142941810) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is (3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name(3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane
PubChem CID142941810
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name(3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane
SMILESC/C=C1\C/C(=C\CC)NCC12CCNCC2
InChIInChI=1S/C14H24N2/c1-3-5-13-10-12(4-2)14(11-16-13)6-8-15-9-7-14/h4-5,15-16H,3,6-11H2,1-2H3/b12-4+,13-5+
InChIKeyWYAUOQSVDGUYLB-QGVJZHQLSA-N
XLogP2.59
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(5Z)-4-methylimino-5-propylidene-3,9-diazaspiro[5.5]undecan-2-one
CID 145360718
(3Z)-7-bromo-3-propylidenespiro[2H-indene-1,4'-piperidine]
CID 58137278
(3Z)-N-methyl-3-propylidene-8-azaspiro[4.5]dec-1-en-4-imine
CID 143423158
2-ethylidenepiperazine;hydrochloride
CID 70106177
2-ethylidene-6-azaspiro[3.4]octane
CID 142581763
6,6-dimethyl-1,4-diazocane
CID 139442519
4,4-diethylpiperidine;hydrochloride
CID 75419509
6-azaspiro[2.5]octane;ethane;propane
CID 176979994
aziridine;propane
CID 160500673
1-ethyl-5,6-dimethoxyspiro[2H-indole-3,4'-piperidine]
CID 83980562
3,9-diazaspiro[5.5]undecane-2,5-dione
CID 59929903
propane;spiro[1,2-dihydroindene-3,4'-piperidine]
CID 91126362

Frequently Asked Questions

What is the IUPAC name of (3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane?
The IUPAC name of (3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane (CID 142941810) is (3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane.
What is the SMILES notation for (3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane?
The canonical SMILES for (3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane is C/C=C1\C/C(=C\CC)NCC12CCNCC2.
What is the InChIKey of (3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane?
The InChIKey is WYAUOQSVDGUYLB-QGVJZHQLSA-N. The full InChI is InChI=1S/C14H24N2/c1-3-5-13-10-12(4-2)14(11-16-13)6-8-15-9-7-14/h4-5,15-16H,3,6-11H2,1-2H3/b12-4+,13-5+.
What are the key properties of (3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane?
(3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane has a molecular weight of 220.36 g/mol, XLogP of 2.59, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,5E)-5-ethylidene-3-propylidene-2,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 142941810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).