ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane

C15H31N — CID 154670982

IUPACethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane
SMILESCC.CCC1CCC2(CCN(C(C)C)C2)C1
InChIInChI=1S/C13H25N.C2H6/c1-4-12-5-6-13(9-12)7-8-14(10-13)11(2)3;1-2/h11-12H,4-10H2,1-3H3;1-2H3
InChIKeyKGUGPVLOVWMUPQ-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.32
Rot. Bonds2

About ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane

ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane (PubChem CID 154670982) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane.

Molecular Properties

Compound Nameethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane
PubChem CID154670982
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Nameethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane
SMILESCC.CCC1CCC2(CCN(C(C)C)C2)C1
InChIInChI=1S/C13H25N.C2H6/c1-4-12-5-6-13(9-12)7-8-14(10-13)11(2)3;1-2/h11-12H,4-10H2,1-3H3;1-2H3
InChIKeyKGUGPVLOVWMUPQ-UHFFFAOYSA-N
XLogP4.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(5R,8R)-8-(bromomethyl)-2-propan-2-yl-2-azaspiro[4.4]nonane
CID 98083969
9-ethyl-3-propan-2-yl-3-azaspiro[5.5]undecane
CID 155034031
8-methyl-2-propan-2-yl-2-azaspiro[4.5]decane
CID 146509979
7-butan-2-yl-2-ethyl-7-azaspiro[3.5]nonane;ethane
CID 176986311
ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane
CID 156798626
ethane;7-ethyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane
CID 164540860
2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonane
CID 163848476
2,7,8-tri(propan-2-yl)-2,8-diazaspiro[4.5]decane
CID 164847437
2-butan-2-yl-8-methyl-2-azaspiro[4.4]nonane
CID 171071187
2,2-difluoro-6-propan-2-yl-6-azaspiro[3.4]octane;ethane
CID 170740276
ethane;2-propan-2-yl-2-azaspiro[4.5]decane
CID 144877753
8,8-dimethyl-2-propan-2-yl-2-azaspiro[4.5]decane
CID 134166256

Frequently Asked Questions

What is the IUPAC name of ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane?
The IUPAC name of ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane (CID 154670982) is ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane.
What is the SMILES notation for ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane?
The canonical SMILES for ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane is CC.CCC1CCC2(CCN(C(C)C)C2)C1.
What is the InChIKey of ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane?
The InChIKey is KGUGPVLOVWMUPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N.C2H6/c1-4-12-5-6-13(9-12)7-8-14(10-13)11(2)3;1-2/h11-12H,4-10H2,1-3H3;1-2H3.
What are the key properties of ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane?
ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane has a molecular weight of 225.42 g/mol, XLogP of 4.32, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;8-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane is sourced from PubChem (CID 154670982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).