1,2,2-Trimethyl-1-azaspiro[4.5]decane

C12H23N — CID 59773900

IUPAC1,2,2-trimethyl-1-azaspiro[4.5]decane
SMILESCC1(CCC2(N1C)CCCCC2)C
InChIInChI=1S/C12H23N/c1-11(2)9-10-12(13(11)3)7-5-4-6-8-12/h4-10H2,1-3H3
InChIKeyYGAVIWBBDJNHLQ-UHFFFAOYSA-N
MW181.32 g/mol
LogP3.00
Rot. Bonds

About 1,2,2-Trimethyl-1-azaspiro[4.5]decane

1,2,2-Trimethyl-1-azaspiro[4.5]decane (PubChem CID 59773900) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 1,2,2-trimethyl-1-azaspiro[4.5]decane.

Molecular Properties

Compound Name1,2,2-Trimethyl-1-azaspiro[4.5]decane
PubChem CID59773900
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name1,2,2-trimethyl-1-azaspiro[4.5]decane
SMILESCC1(CCC2(N1C)CCCCC2)C
InChIInChI=1S/C12H23N/c1-11(2)9-10-12(13(11)3)7-5-4-6-8-12/h4-10H2,1-3H3
InChIKeyYGAVIWBBDJNHLQ-UHFFFAOYSA-N
XLogP3.00
TPSA3.20 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity189

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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2-Cyclohexyl-1-ethylpyrrolidine
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3-Fluoro-1-(5-methylnonan-5-yl)pyrrolidine
CID 123170121
3-Fluoro-1-(3-methylnonan-3-yl)pyrrolidine
CID 146620912
1-(2-Fluoroethyl)-1-azaspiro[4.5]decane
CID 131130404
1-(3-Ethylheptan-3-yl)pyrrolidine
CID 11745601
1-Cyclohexyl-2,2-dimethylpyrrolidine
CID 101621298
1-(1-Methylcyclohexyl)pyrrolidine
CID 417918
1-(1,3,3,5,5-Pentamethylcyclohexyl)pyrrolidine
CID 9815927
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Frequently Asked Questions

What is the IUPAC name of 1,2,2-Trimethyl-1-azaspiro[4.5]decane?
The IUPAC name of 1,2,2-Trimethyl-1-azaspiro[4.5]decane (CID 59773900) is 1,2,2-trimethyl-1-azaspiro[4.5]decane.
What is the SMILES notation for 1,2,2-Trimethyl-1-azaspiro[4.5]decane?
The canonical SMILES for 1,2,2-Trimethyl-1-azaspiro[4.5]decane is CC1(CCC2(N1C)CCCCC2)C.
What is the InChIKey of 1,2,2-Trimethyl-1-azaspiro[4.5]decane?
The InChIKey is YGAVIWBBDJNHLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-11(2)9-10-12(13(11)3)7-5-4-6-8-12/h4-10H2,1-3H3.
What are the key properties of 1,2,2-Trimethyl-1-azaspiro[4.5]decane?
1,2,2-Trimethyl-1-azaspiro[4.5]decane has a molecular weight of 181.32 g/mol, XLogP of 3.00, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2-Trimethyl-1-azaspiro[4.5]decane is sourced from PubChem (CID 59773900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).