ethane;1-oxaspiro[4.5]decan-8-amine

C11H23NO — CID 143817931

IUPACethane;1-oxaspiro[4.5]decan-8-amine
SMILESCC.NC1CCC2(CCCO2)CC1
InChIInChI=1S/C9H17NO.C2H6/c10-8-2-5-9(6-3-8)4-1-7-11-9;1-2/h8H,1-7,10H2;1-2H3
InChIKeyWUTDIAGWMMMOEZ-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.46
Rot. Bonds

About ethane;1-oxaspiro[4.5]decan-8-amine

ethane;1-oxaspiro[4.5]decan-8-amine (PubChem CID 143817931) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is ethane;1-oxaspiro[4.5]decan-8-amine.

Molecular Properties

Compound Nameethane;1-oxaspiro[4.5]decan-8-amine
PubChem CID143817931
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Nameethane;1-oxaspiro[4.5]decan-8-amine
SMILESCC.NC1CCC2(CCCO2)CC1
InChIInChI=1S/C9H17NO.C2H6/c10-8-2-5-9(6-3-8)4-1-7-11-9;1-2/h8H,1-7,10H2;1-2H3
InChIKeyWUTDIAGWMMMOEZ-UHFFFAOYSA-N
XLogP2.46
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;1-oxaspiro[4.5]decan-8-amine?
The IUPAC name of ethane;1-oxaspiro[4.5]decan-8-amine (CID 143817931) is ethane;1-oxaspiro[4.5]decan-8-amine.
What is the SMILES notation for ethane;1-oxaspiro[4.5]decan-8-amine?
The canonical SMILES for ethane;1-oxaspiro[4.5]decan-8-amine is CC.NC1CCC2(CCCO2)CC1.
What is the InChIKey of ethane;1-oxaspiro[4.5]decan-8-amine?
The InChIKey is WUTDIAGWMMMOEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO.C2H6/c10-8-2-5-9(6-3-8)4-1-7-11-9;1-2/h8H,1-7,10H2;1-2H3.
What are the key properties of ethane;1-oxaspiro[4.5]decan-8-amine?
ethane;1-oxaspiro[4.5]decan-8-amine has a molecular weight of 185.31 g/mol, XLogP of 2.46, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-oxaspiro[4.5]decan-8-amine is sourced from PubChem (CID 143817931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).