4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane

C11H19N — CID 163444318

IUPAC4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane
SMILESC=CN1CCCC12CC2C(C)C
InChIInChI=1S/C11H19N/c1-4-12-7-5-6-11(12)8-10(11)9(2)3/h4,9-10H,1,5-8H2,2-3H3
InChIKeyBBFFOABETQMCGY-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.64
Rot. Bonds2

About 4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane

4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane (PubChem CID 163444318) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane.

Molecular Properties

Compound Name4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane
PubChem CID163444318
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane
SMILESC=CN1CCCC12CC2C(C)C
InChIInChI=1S/C11H19N/c1-4-12-7-5-6-11(12)8-10(11)9(2)3/h4,9-10H,1,5-8H2,2-3H3
InChIKeyBBFFOABETQMCGY-UHFFFAOYSA-N
XLogP2.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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(2R)-2-methyl-7-propan-2-yl-7-azaspiro[2.6]nonane
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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane?
The IUPAC name of 4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane (CID 163444318) is 4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane.
What is the SMILES notation for 4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane?
The canonical SMILES for 4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane is C=CN1CCCC12CC2C(C)C.
What is the InChIKey of 4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane?
The InChIKey is BBFFOABETQMCGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-4-12-7-5-6-11(12)8-10(11)9(2)3/h4,9-10H,1,5-8H2,2-3H3.
What are the key properties of 4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane?
4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane has a molecular weight of 165.28 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2-propan-2-yl-4-azaspiro[2.4]heptane is sourced from PubChem (CID 163444318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).