1-propan-2-yl-2-azaspiro[4.5]decane

C12H23N — CID 82601210

IUPAC1-propan-2-yl-2-azaspiro[4.5]decane
SMILESCC(C)C1NCCC12CCCCC2
InChIInChI=1S/C12H23N/c1-10(2)11-12(8-9-13-11)6-4-3-5-7-12/h10-11,13H,3-9H2,1-2H3
InChIKeyRYSMCUNZMOEQHU-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.95
Rot. Bonds1

About 1-propan-2-yl-2-azaspiro[4.5]decane

1-propan-2-yl-2-azaspiro[4.5]decane (PubChem CID 82601210) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 1-propan-2-yl-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name1-propan-2-yl-2-azaspiro[4.5]decane
PubChem CID82601210
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name1-propan-2-yl-2-azaspiro[4.5]decane
SMILESCC(C)C1NCCC12CCCCC2
InChIInChI=1S/C12H23N/c1-10(2)11-12(8-9-13-11)6-4-3-5-7-12/h10-11,13H,3-9H2,1-2H3
InChIKeyRYSMCUNZMOEQHU-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-2-azaspiro[4.5]decane?
The IUPAC name of 1-propan-2-yl-2-azaspiro[4.5]decane (CID 82601210) is 1-propan-2-yl-2-azaspiro[4.5]decane.
What is the SMILES notation for 1-propan-2-yl-2-azaspiro[4.5]decane?
The canonical SMILES for 1-propan-2-yl-2-azaspiro[4.5]decane is CC(C)C1NCCC12CCCCC2.
What is the InChIKey of 1-propan-2-yl-2-azaspiro[4.5]decane?
The InChIKey is RYSMCUNZMOEQHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-10(2)11-12(8-9-13-11)6-4-3-5-7-12/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 1-propan-2-yl-2-azaspiro[4.5]decane?
1-propan-2-yl-2-azaspiro[4.5]decane has a molecular weight of 181.32 g/mol, XLogP of 2.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-2-azaspiro[4.5]decane is sourced from PubChem (CID 82601210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).