5-ethyl-7-methylidene-5-azaspiro[2.4]heptane

C9H15N — CID 59200749

IUPAC5-ethyl-7-methylidene-5-azaspiro[2.4]heptane
SMILESC=C1CN(CC)CC12CC2
InChIInChI=1S/C9H15N/c1-3-10-6-8(2)9(7-10)4-5-9/h2-7H2,1H3
InChIKeyDENZIPWCIUOBKL-UHFFFAOYSA-N
MW137.23 g/mol
LogP1.66
Rot. Bonds1

About 5-ethyl-7-methylidene-5-azaspiro[2.4]heptane

5-ethyl-7-methylidene-5-azaspiro[2.4]heptane (PubChem CID 59200749) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 5-ethyl-7-methylidene-5-azaspiro[2.4]heptane.

Molecular Properties

Compound Name5-ethyl-7-methylidene-5-azaspiro[2.4]heptane
PubChem CID59200749
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name5-ethyl-7-methylidene-5-azaspiro[2.4]heptane
SMILESC=C1CN(CC)CC12CC2
InChIInChI=1S/C9H15N/c1-3-10-6-8(2)9(7-10)4-5-9/h2-7H2,1H3
InChIKeyDENZIPWCIUOBKL-UHFFFAOYSA-N
XLogP1.66
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 57580041
1,3,3-Trimethyl-4-methylidenepyrrolidine
CID 57908106
1-Methyl-3-prop-1-en-2-ylpyrrolidine
CID 90406127
Ethane;1-methyl-3-(1-methylcyclopropyl)-2,5-dihydropyrrole
CID 91449953
(6S)-6-ethenyl-5-methyl-5-azaspiro[2.4]heptane
CID 145013341
N-[(1-prop-1-en-2-ylcyclopropyl)methyl]-N-propylpropan-1-amine
CID 156314893
5-Methyl-6-prop-1-en-2-yl-5-azaspiro[2.4]heptane
CID 164069231
5-methyl-5-[(E)-2-methylbut-2-enyl]-5-azoniaspiro[2.4]heptane
CID 174339892
1-[[1-(2,2-Dimethylpropyl)cyclopropyl]methyl]-3-methylidenepyrrolidine
CID 176778556
1-[(1-Prop-1-en-2-ylcyclopropyl)methyl]pyrrolidine
CID 142836451
1-(4,4-Dimethyl-2-methylidenepentyl)pyrrolidine
CID 143530039

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-7-methylidene-5-azaspiro[2.4]heptane?
The IUPAC name of 5-ethyl-7-methylidene-5-azaspiro[2.4]heptane (CID 59200749) is 5-ethyl-7-methylidene-5-azaspiro[2.4]heptane.
What is the SMILES notation for 5-ethyl-7-methylidene-5-azaspiro[2.4]heptane?
The canonical SMILES for 5-ethyl-7-methylidene-5-azaspiro[2.4]heptane is C=C1CN(CC)CC12CC2.
What is the InChIKey of 5-ethyl-7-methylidene-5-azaspiro[2.4]heptane?
The InChIKey is DENZIPWCIUOBKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-3-10-6-8(2)9(7-10)4-5-9/h2-7H2,1H3.
What are the key properties of 5-ethyl-7-methylidene-5-azaspiro[2.4]heptane?
5-ethyl-7-methylidene-5-azaspiro[2.4]heptane has a molecular weight of 137.23 g/mol, XLogP of 1.66, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-7-methylidene-5-azaspiro[2.4]heptane is sourced from PubChem (CID 59200749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).