3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene

C14H25N — CID 177162327

IUPAC3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene
SMILESCCC1=C(C)C2(CCN(C)CC2)CC1C
InChIInChI=1S/C14H25N/c1-5-13-11(2)10-14(12(13)3)6-8-15(4)9-7-14/h11H,5-10H2,1-4H3
InChIKeyJXQPEPKVNUERDK-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.46
Rot. Bonds1

About 3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene

3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene (PubChem CID 177162327) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene.

Molecular Properties

Compound Name3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene
PubChem CID177162327
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene
SMILESCCC1=C(C)C2(CCN(C)CC2)CC1C
InChIInChI=1S/C14H25N/c1-5-13-11(2)10-14(12(13)3)6-8-15(4)9-7-14/h11H,5-10H2,1-4H3
InChIKeyJXQPEPKVNUERDK-UHFFFAOYSA-N
XLogP3.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.46
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

ethane;3-ethyl-2,4,8-trimethyl-1-oxa-8-azaspiro[4.5]dec-3-ene
CID 177162575
ethane;(2,3,9-trimethyl-9-azaspiro[4.6]undec-3-en-4-yl)phosphane
CID 177162678
2,8-dimethyl-3-propyl-1-oxa-3,8-diazaspiro[4.5]decane
CID 173100464
(2R)-2,3,4,8-tetramethyl-1-oxa-8-azaspiro[4.5]dec-3-ene
CID 177161814
2-ethyl-8-methyl-1-thia-4,8-diazaspiro[4.5]decan-3-one;hydrate
CID 174160296
(2S)-2-ethyl-8-methyl-1-thia-4,8-diazaspiro[4.5]decan-3-one;hydrochloride
CID 154731017
[4-(cyclopropylmethyl)-1-methylpiperidin-4-yl]methanol
CID 70641658
N,N-diethyl-7-methyl-7-azaspiro[3.5]nonan-2-amine
CID 166872462
diethyl 1-methylpiperidine-4,4-dicarboxylate
CID 121001338
2-ethyl-4,8-dimethyl-1-thia-4,8-diazaspiro[4.5]decan-3-one
CID 22097515
3,8-dimethyl-8-azaspiro[4.5]decane
CID 22975666
(2S,5S)-2,3,4,9-tetramethyl-1-oxa-9-azaspiro[4.6]undec-3-ene
CID 176830232

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene?
The IUPAC name of 3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene (CID 177162327) is 3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene.
What is the SMILES notation for 3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene?
The canonical SMILES for 3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene is CCC1=C(C)C2(CCN(C)CC2)CC1C.
What is the InChIKey of 3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene?
The InChIKey is JXQPEPKVNUERDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-5-13-11(2)10-14(12(13)3)6-8-15(4)9-7-14/h11H,5-10H2,1-4H3.
What are the key properties of 3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene?
3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene has a molecular weight of 207.36 g/mol, XLogP of 3.46, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2,4,8-trimethyl-8-azaspiro[4.5]dec-3-ene is sourced from PubChem (CID 177162327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).