ethane;6-ethoxy-2-azaspiro[3.3]heptane

C10H21NO — CID 170737877

IUPACethane;6-ethoxy-2-azaspiro[3.3]heptane
SMILESCC.CCOC1CC2(CNC2)C1
InChIInChI=1S/C8H15NO.C2H6/c1-2-10-7-3-8(4-7)5-9-6-8;1-2/h7,9H,2-6H2,1H3;1-2H3
InChIKeyUSQOVBCQLOUQSH-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.80
Rot. Bonds2

About ethane;6-ethoxy-2-azaspiro[3.3]heptane

ethane;6-ethoxy-2-azaspiro[3.3]heptane (PubChem CID 170737877) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is ethane;6-ethoxy-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Nameethane;6-ethoxy-2-azaspiro[3.3]heptane
PubChem CID170737877
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Nameethane;6-ethoxy-2-azaspiro[3.3]heptane
SMILESCC.CCOC1CC2(CNC2)C1
InChIInChI=1S/C8H15NO.C2H6/c1-2-10-7-3-8(4-7)5-9-6-8;1-2/h7,9H,2-6H2,1H3;1-2H3
InChIKeyUSQOVBCQLOUQSH-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(bromomethyl)-5-ethoxyspiro[2.3]hexane
CID 106824984
ethane;2-ethoxy-7-propan-2-yl-7-azaspiro[3.5]nonane
CID 170581774
3-ethoxyazetidine
CID 22507733
2-ethoxy-7-propan-2-ylspiro[3.5]nonane
CID 176983956
6-ethoxy-1-azaspiro[3.3]heptane
CID 106824536
(5-ethoxyspiro[2.3]hexan-2-yl)methanamine
CID 106824123
ethane;3-ethoxypyrrolidine
CID 142624915
4-ethoxy-2,2,7,7-tetramethylazepane
CID 122414797
1-bromo-3-ethoxycyclobutane-1-carbonitrile
CID 106824047
4-ethoxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
CID 18371974
2-ethoxy-5-thia-8-azaspiro[3.4]octane
CID 106824053
N-[(5-ethoxyspiro[2.3]hexan-2-yl)methyl]ethanamine
CID 106824127

Frequently Asked Questions

What is the IUPAC name of ethane;6-ethoxy-2-azaspiro[3.3]heptane?
The IUPAC name of ethane;6-ethoxy-2-azaspiro[3.3]heptane (CID 170737877) is ethane;6-ethoxy-2-azaspiro[3.3]heptane.
What is the SMILES notation for ethane;6-ethoxy-2-azaspiro[3.3]heptane?
The canonical SMILES for ethane;6-ethoxy-2-azaspiro[3.3]heptane is CC.CCOC1CC2(CNC2)C1.
What is the InChIKey of ethane;6-ethoxy-2-azaspiro[3.3]heptane?
The InChIKey is USQOVBCQLOUQSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.C2H6/c1-2-10-7-3-8(4-7)5-9-6-8;1-2/h7,9H,2-6H2,1H3;1-2H3.
What are the key properties of ethane;6-ethoxy-2-azaspiro[3.3]heptane?
ethane;6-ethoxy-2-azaspiro[3.3]heptane has a molecular weight of 171.28 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-ethoxy-2-azaspiro[3.3]heptane is sourced from PubChem (CID 170737877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).