ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol

C11H23NO — CID 169236503

IUPACethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol
SMILESCC.CN1CC(CO)C2(CCC2)C1
InChIInChI=1S/C9H17NO.C2H6/c1-10-5-8(6-11)9(7-10)3-2-4-9;1-2/h8,11H,2-7H2,1H3;1-2H3
InChIKeyVRFMPZWMWRVBJS-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.74
Rot. Bonds1

About ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol

ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol (PubChem CID 169236503) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol.

Molecular Properties

Compound Nameethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol
PubChem CID169236503
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Nameethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol
SMILESCC.CN1CC(CO)C2(CCC2)C1
InChIInChI=1S/C9H17NO.C2H6/c1-10-5-8(6-11)9(7-10)3-2-4-9;1-2/h8,11H,2-7H2,1H3;1-2H3
InChIKeyVRFMPZWMWRVBJS-UHFFFAOYSA-N
XLogP1.74
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol?
The IUPAC name of ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol (CID 169236503) is ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol.
What is the SMILES notation for ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol?
The canonical SMILES for ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol is CC.CN1CC(CO)C2(CCC2)C1.
What is the InChIKey of ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol?
The InChIKey is VRFMPZWMWRVBJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO.C2H6/c1-10-5-8(6-11)9(7-10)3-2-4-9;1-2/h8,11H,2-7H2,1H3;1-2H3.
What are the key properties of ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol?
ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol has a molecular weight of 185.31 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(6-methyl-6-azaspiro[3.4]octan-8-yl)methanol is sourced from PubChem (CID 169236503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).