2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine

C15H24N2 — CID 178161582

IUPAC2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine
SMILESC=C/C(C)=C\C1=C(C)CC2(CCN(N)CC2)C1
InChIInChI=1S/C15H24N2/c1-4-12(2)9-14-11-15(10-13(14)3)5-7-17(16)8-6-15/h4,9H,1,5-8,10-11,16H2,2-3H3/b12-9-
InChIKeyLXJCCSPVOLNQOX-XFXZXTDPSA-N
MW232.37 g/mol
LogP3.18
Rot. Bonds2

About 2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine

2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine (PubChem CID 178161582) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine.

Molecular Properties

Compound Name2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine
PubChem CID178161582
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine
SMILESC=C/C(C)=C\C1=C(C)CC2(CCN(N)CC2)C1
InChIInChI=1S/C15H24N2/c1-4-12(2)9-14-11-15(10-13(14)3)5-7-17(16)8-6-15/h4,9H,1,5-8,10-11,16H2,2-3H3/b12-9-
InChIKeyLXJCCSPVOLNQOX-XFXZXTDPSA-N
XLogP3.18
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-Buta-1,3-dienyl-4,8-dimethyl-8-azaspiro[4.5]dec-3-ene
CID 123471157
(2R)-3,3-dimethyl-2-[(4-methylcyclohepta-1,4,6-trien-1-yl)methyl]-4-methylidenepiperidin-1-amine;ethane
CID 141860440
3,4-Bis(ethenyl)-8-methyl-8-azaspiro[4.5]dec-3-ene
CID 142848976
3-Cyclohexa-1,3-dien-1-ylpyrrolidin-1-amine
CID 143177449
2,3-Bis(ethenyl)-8-ethyl-8-azaspiro[4.5]dec-2-ene
CID 143759764
2,3-Bis(ethenyl)-7-methyl-7-azaspiro[4.5]dec-2-ene
CID 143759800
4-Ethenyl-3,8-dimethyl-8-azaspiro[4.5]dec-3-ene;prop-1-ene
CID 143782115
4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-8-azaspiro[4.5]dec-3-ene
CID 143782142
3-[(1Z)-buta-1,3-dienyl]-2-methyl-8-azaspiro[4.5]dec-2-ene
CID 155702976
2-methyl-3-[(1Z,3Z)-penta-1,3-dienyl]-8-azaspiro[4.5]dec-2-ene
CID 155703007
3-[(1Z)-buta-1,3-dienyl]-2-ethenyl-8-ethyl-8-azaspiro[4.5]dec-2-ene;ethane
CID 155709835
2,3-Bis(ethenyl)-8-methyl-8-azaspiro[4.5]dec-2-ene
CID 169122929

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine?
The IUPAC name of 2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine (CID 178161582) is 2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine.
What is the SMILES notation for 2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine?
The canonical SMILES for 2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine is C=C/C(C)=C\C1=C(C)CC2(CCN(N)CC2)C1.
What is the InChIKey of 2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine?
The InChIKey is LXJCCSPVOLNQOX-XFXZXTDPSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-12(2)9-14-11-15(10-13(14)3)5-7-17(16)8-6-15/h4,9H,1,5-8,10-11,16H2,2-3H3/b12-9-.
What are the key properties of 2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine?
2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine has a molecular weight of 232.37 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine is sourced from PubChem (CID 178161582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).