10-ethyl-2-azaspiro[5.5]undecan-3-one

C12H21NO — CID 102737330

IUPAC10-ethyl-2-azaspiro[5.5]undecan-3-one
SMILESCCC1CCCC2(CCC(=O)NC2)C1
InChIInChI=1S/C12H21NO/c1-2-10-4-3-6-12(8-10)7-5-11(14)13-9-12/h10H,2-9H2,1H3,(H,13,14)
InChIKeyRJHWGASLCXUXTP-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.48
Rot. Bonds1

About 10-ethyl-2-azaspiro[5.5]undecan-3-one

10-ethyl-2-azaspiro[5.5]undecan-3-one (PubChem CID 102737330) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 10-ethyl-2-azaspiro[5.5]undecan-3-one.

Molecular Properties

Compound Name10-ethyl-2-azaspiro[5.5]undecan-3-one
PubChem CID102737330
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name10-ethyl-2-azaspiro[5.5]undecan-3-one
SMILESCCC1CCCC2(CCC(=O)NC2)C1
InChIInChI=1S/C12H21NO/c1-2-10-4-3-6-12(8-10)7-5-11(14)13-9-12/h10H,2-9H2,1H3,(H,13,14)
InChIKeyRJHWGASLCXUXTP-UHFFFAOYSA-N
XLogP2.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 10-ethyl-2-azaspiro[5.5]undecan-3-one?
The IUPAC name of 10-ethyl-2-azaspiro[5.5]undecan-3-one (CID 102737330) is 10-ethyl-2-azaspiro[5.5]undecan-3-one.
What is the SMILES notation for 10-ethyl-2-azaspiro[5.5]undecan-3-one?
The canonical SMILES for 10-ethyl-2-azaspiro[5.5]undecan-3-one is CCC1CCCC2(CCC(=O)NC2)C1.
What is the InChIKey of 10-ethyl-2-azaspiro[5.5]undecan-3-one?
The InChIKey is RJHWGASLCXUXTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-2-10-4-3-6-12(8-10)7-5-11(14)13-9-12/h10H,2-9H2,1H3,(H,13,14).
What are the key properties of 10-ethyl-2-azaspiro[5.5]undecan-3-one?
10-ethyl-2-azaspiro[5.5]undecan-3-one has a molecular weight of 195.31 g/mol, XLogP of 2.48, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-ethyl-2-azaspiro[5.5]undecan-3-one is sourced from PubChem (CID 102737330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).