9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane

C14H26N2 — CID 170578329

IUPAC9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane
SMILESC/C=C/N1CCCC2(CCN(CC)CC2)C1
InChIInChI=1S/C14H26N2/c1-3-9-16-10-5-6-14(13-16)7-11-15(4-2)12-8-14/h3,9H,4-8,10-13H2,1-2H3/b9-3+
InChIKeyLIYKEHLEDNTEHW-YCRREMRBSA-N
MW222.38 g/mol
LogP2.72
Rot. Bonds2

About 9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane

9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane (PubChem CID 170578329) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane
PubChem CID170578329
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane
SMILESC/C=C/N1CCCC2(CCN(CC)CC2)C1
InChIInChI=1S/C14H26N2/c1-3-9-16-10-5-6-14(13-16)7-11-15(4-2)12-8-14/h3,9H,4-8,10-13H2,1-2H3/b9-3+
InChIKeyLIYKEHLEDNTEHW-YCRREMRBSA-N
XLogP2.72
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,9-diethyl-3,9-diazaspiro[5.5]undecane
CID 20622591
9-ethyl-2-propyl-2,9-diazaspiro[4.5]decane
CID 129100662
7-tert-butyl-2-ethyl-2,7-diazaspiro[4.5]decane
CID 118001208
2-ethyl-2-azaspiro[3.3]heptane
CID 130337259
1-(8-ethyl-2,8-diazaspiro[4.5]decan-2-yl)-2,2,2-trifluoroethanone
CID 91172286
7-[(E)-but-2-enyl]-7-azaspiro[3.5]nonane
CID 131237372
CID 153390108
CID 153390108
ethane;2-ethyl-8-methyl-2,8-diazaspiro[3.5]nonane
CID 177048791
8-tert-butyl-2-ethyl-2,8-diazaspiro[4.5]decane
CID 147776127
1-ethyl-4-methoxyazepane-4-carbaldehyde
CID 105441684
9-(cyclopropylmethyl)-2-methyl-2,9-diazaspiro[5.5]undecane
CID 171845215
1-ethyl-5,5-difluoroazocane
CID 162614940

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane?
The IUPAC name of 9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane (CID 170578329) is 9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane?
The canonical SMILES for 9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane is C/C=C/N1CCCC2(CCN(CC)CC2)C1.
What is the InChIKey of 9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane?
The InChIKey is LIYKEHLEDNTEHW-YCRREMRBSA-N. The full InChI is InChI=1S/C14H26N2/c1-3-9-16-10-5-6-14(13-16)7-11-15(4-2)12-8-14/h3,9H,4-8,10-13H2,1-2H3/b9-3+.
What are the key properties of 9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane?
9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane has a molecular weight of 222.38 g/mol, XLogP of 2.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-2-[(E)-prop-1-enyl]-2,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 170578329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).