ethane;7-ethyl-6-azaspiro[2.5]octane

C11H23N — CID 153391917

IUPACethane;7-ethyl-6-azaspiro[2.5]octane
SMILESCC.CCC1CC2(CCN1)CC2
InChIInChI=1S/C9H17N.C2H6/c1-2-8-7-9(3-4-9)5-6-10-8;1-2/h8,10H,2-7H2,1H3;1-2H3
InChIKeyKXTLPMXSJSJYRU-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.95
Rot. Bonds1

About ethane;7-ethyl-6-azaspiro[2.5]octane

ethane;7-ethyl-6-azaspiro[2.5]octane (PubChem CID 153391917) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is ethane;7-ethyl-6-azaspiro[2.5]octane.

Molecular Properties

Compound Nameethane;7-ethyl-6-azaspiro[2.5]octane
PubChem CID153391917
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Nameethane;7-ethyl-6-azaspiro[2.5]octane
SMILESCC.CCC1CC2(CCN1)CC2
InChIInChI=1S/C9H17N.C2H6/c1-2-8-7-9(3-4-9)5-6-10-8;1-2/h8,10H,2-7H2,1H3;1-2H3
InChIKeyKXTLPMXSJSJYRU-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7-ethyl-6-azaspiro[2.5]octane
CID 153391918
6-azaspiro[2.5]octan-7-ylmethanol;ethane
CID 144510443
ethane;2-ethylazetidine
CID 90717086
ethane;3-ethyl-8-azaspiro[4.5]decane
CID 170578114
6-propyl-5-azaspiro[2.4]heptane
CID 144802618
6-azaspiro[2.5]octane;ethane;propane
CID 176979994
9-methyl-8-azaspiro[4.5]decane
CID 118001586
4,4-difluoro-2-(2-methylpropyl)piperidine
CID 84767422
ethane;(2R)-2-ethylpyrrolidine;molecular hydrogen;hydrofluoride
CID 178147337
ethane;2-ethyl-4-methylpiperidine
CID 142379207
5,6-diethylspiro[2.4]heptane
CID 177192839
2-ethylpiperidine;hydrobromide
CID 131717239

Frequently Asked Questions

What is the IUPAC name of ethane;7-ethyl-6-azaspiro[2.5]octane?
The IUPAC name of ethane;7-ethyl-6-azaspiro[2.5]octane (CID 153391917) is ethane;7-ethyl-6-azaspiro[2.5]octane.
What is the SMILES notation for ethane;7-ethyl-6-azaspiro[2.5]octane?
The canonical SMILES for ethane;7-ethyl-6-azaspiro[2.5]octane is CC.CCC1CC2(CCN1)CC2.
What is the InChIKey of ethane;7-ethyl-6-azaspiro[2.5]octane?
The InChIKey is KXTLPMXSJSJYRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N.C2H6/c1-2-8-7-9(3-4-9)5-6-10-8;1-2/h8,10H,2-7H2,1H3;1-2H3.
What are the key properties of ethane;7-ethyl-6-azaspiro[2.5]octane?
ethane;7-ethyl-6-azaspiro[2.5]octane has a molecular weight of 169.31 g/mol, XLogP of 2.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;7-ethyl-6-azaspiro[2.5]octane is sourced from PubChem (CID 153391917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).