2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane

C14H26N2 — CID 56703340

IUPAC2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane
SMILESCCC/C=C/CN1CCC2(CCNCC2)C1
InChIInChI=1S/C14H26N2/c1-2-3-4-5-11-16-12-8-14(13-16)6-9-15-10-7-14/h4-5,15H,2-3,6-13H2,1H3/b5-4+
InChIKeyCGYAQKXXUQVUIO-SNAWJCMRSA-N
MW222.38 g/mol
LogP2.42
Rot. Bonds4

About 2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane

2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane (PubChem CID 56703340) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane
PubChem CID56703340
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane
SMILESCCC/C=C/CN1CCC2(CCNCC2)C1
InChIInChI=1S/C14H26N2/c1-2-3-4-5-11-16-12-8-14(13-16)6-9-15-10-7-14/h4-5,15H,2-3,6-13H2,1H3/b5-4+
InChIKeyCGYAQKXXUQVUIO-SNAWJCMRSA-N
XLogP2.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[(2Z,5E)-5-fluorohepta-2,5-dienyl]-4-methylpiperidine
CID 164862654
2-[(2E)-2-methyl-2-buten-1-yl]-2,8-diazaspiro[4.5]decane dihydrochloride
CID 56718814
8-Azaspiro[4.5]dec-2-ene
CID 22341335
3,8-Diazaspiro[5.6]dodec-10-ene
CID 23135202
3,8-Diazaspiro[5.6]dodec-11-ene
CID 23135227
2,7-Diazaspiro[4.6]undec-9-ene
CID 23135340
2,9-Diazaspiro[5.5]undec-4-ene
CID 53646663
1-methanidyl-4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidin-1-ium
CID 57987018
4-Ethylidene-8-azaspiro[4.5]dec-1-ene
CID 68193992
3-Piperidin-4-ylprop-2-en-1-amine
CID 69526961
4-Methyl-8-azaspiro[4.5]dec-2-ene
CID 70299058
(E)-N-methyl-N-(piperidin-4-ylmethyl)pent-3-en-1-amine
CID 70321782

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane?
The IUPAC name of 2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane (CID 56703340) is 2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane is CCC/C=C/CN1CCC2(CCNCC2)C1.
What is the InChIKey of 2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane?
The InChIKey is CGYAQKXXUQVUIO-SNAWJCMRSA-N. The full InChI is InChI=1S/C14H26N2/c1-2-3-4-5-11-16-12-8-14(13-16)6-9-15-10-7-14/h4-5,15H,2-3,6-13H2,1H3/b5-4+.
What are the key properties of 2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane?
2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane has a molecular weight of 222.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-hex-2-enyl]-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 56703340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).