ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane

C10H22N2O — CID 170571668

IUPACethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane
SMILESCC.CN1CCOCC2(CCN2)C1
InChIInChI=1S/C8H16N2O.C2H6/c1-10-4-5-11-7-8(6-10)2-3-9-8;1-2/h9H,2-7H2,1H3;1-2H3
InChIKeyXVXDNXFJDRRIQW-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.71
Rot. Bonds

About ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane

ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane (PubChem CID 170571668) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane.

Molecular Properties

Compound Nameethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane
PubChem CID170571668
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Nameethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane
SMILESCC.CN1CCOCC2(CCN2)C1
InChIInChI=1S/C8H16N2O.C2H6/c1-10-4-5-11-7-8(6-10)2-3-9-8;1-2/h9H,2-7H2,1H3;1-2H3
InChIKeyXVXDNXFJDRRIQW-UHFFFAOYSA-N
XLogP0.71
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane?
The IUPAC name of ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane (CID 170571668) is ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane.
What is the SMILES notation for ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane?
The canonical SMILES for ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane is CC.CN1CCOCC2(CCN2)C1.
What is the InChIKey of ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane?
The InChIKey is XVXDNXFJDRRIQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O.C2H6/c1-10-4-5-11-7-8(6-10)2-3-9-8;1-2/h9H,2-7H2,1H3;1-2H3.
What are the key properties of ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane?
ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane has a molecular weight of 186.30 g/mol, XLogP of 0.71, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methyl-9-oxa-1,6-diazaspiro[3.6]decane is sourced from PubChem (CID 170571668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).