ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol

C13H25NO2 — CID 178038185

IUPACethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol
SMILESCC.OCC1(CN2CC3(CCOC3)C2)CC1
InChIInChI=1S/C11H19NO2.C2H6/c13-8-10(1-2-10)5-12-6-11(7-12)3-4-14-9-11;1-2/h13H,1-9H2;1-2H3
InChIKeyJVEUDUZTDIKLGM-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.51
Rot. Bonds3

About ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol

ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol (PubChem CID 178038185) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol.

Molecular Properties

Compound Nameethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol
PubChem CID178038185
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Nameethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol
SMILESCC.OCC1(CN2CC3(CCOC3)C2)CC1
InChIInChI=1S/C11H19NO2.C2H6/c13-8-10(1-2-10)5-12-6-11(7-12)3-4-14-9-11;1-2/h13H,1-9H2;1-2H3
InChIKeyJVEUDUZTDIKLGM-UHFFFAOYSA-N
XLogP1.51
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(1R)-2,2-difluoro-1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol
CID 172588196
[1-[(3,3-Dimethylazetidin-1-yl)methyl]cyclopropyl]methanol
CID 104550683
2-Propyl-6-oxa-2-azaspiro[3.4]octane
CID 153356037
[1-(Azetidin-1-ylmethyl)cyclopropyl]methanol;ethane
CID 164878810
Ethane;2-ethyl-6-oxa-2-azaspiro[3.4]octane
CID 165403357
1-(6-Oxa-2-azaspiro[3.4]octan-2-yl)ethanol
CID 167219976
2-[[1-(Propan-2-yloxymethyl)cyclopropyl]methyl]-6-oxa-2-azaspiro[3.4]octane
CID 169658931
2-[(1-Methylcyclopropyl)methyl]-6-oxa-2-azaspiro[3.4]octane
CID 170374668
1-(2-Oxa-7-azaspiro[3.4]octan-7-yl)ethanol
CID 170785278
Ethane;2-propyl-6-oxa-2-azaspiro[3.4]octane
CID 171514883
Ethane;2-propyl-6-oxa-2-azaspiro[3.4]octane
CID 171516049
Ethane;[1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidin-3-yl]methanol
CID 172348365

Frequently Asked Questions

What is the IUPAC name of ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol?
The IUPAC name of ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol (CID 178038185) is ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol.
What is the SMILES notation for ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol?
The canonical SMILES for ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol is CC.OCC1(CN2CC3(CCOC3)C2)CC1.
What is the InChIKey of ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol?
The InChIKey is JVEUDUZTDIKLGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2.C2H6/c13-8-10(1-2-10)5-12-6-11(7-12)3-4-14-9-11;1-2/h13H,1-9H2;1-2H3.
What are the key properties of ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol?
ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol has a molecular weight of 227.35 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;[1-(6-oxa-2-azaspiro[3.4]octan-2-ylmethyl)cyclopropyl]methanol is sourced from PubChem (CID 178038185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).