spiro[2H-1-benzofuran-3,2'-morpholine]

C11H13NO2 — CID 112545638

IUPACspiro[2H-1-benzofuran-3,2'-morpholine]
SMILESc1ccc2c(c1)OCC21CNCCO1
InChIInChI=1S/C11H13NO2/c1-2-4-10-9(3-1)11(8-13-10)7-12-5-6-14-11/h1-4,12H,5-8H2
InChIKeyORGQCDNDBFWVFF-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.89
Rot. Bonds

About spiro[2H-1-benzofuran-3,2'-morpholine]

spiro[2H-1-benzofuran-3,2'-morpholine] (PubChem CID 112545638) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is spiro[2H-1-benzofuran-3,2'-morpholine].

Molecular Properties

Compound Namespiro[2H-1-benzofuran-3,2'-morpholine]
PubChem CID112545638
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Namespiro[2H-1-benzofuran-3,2'-morpholine]
SMILESc1ccc2c(c1)OCC21CNCCO1
InChIInChI=1S/C11H13NO2/c1-2-4-10-9(3-1)11(8-13-10)7-12-5-6-14-11/h1-4,12H,5-8H2
InChIKeyORGQCDNDBFWVFF-UHFFFAOYSA-N
XLogP0.89
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methylspiro[2H-indole-3,2'-morpholine]
CID 112545926
spiro[2H-1-benzofuran-3,3'-piperidine];hydrochloride
CID 146155745
1-methylspiro[2,3-dihydro-1H-naphthalene-4,2'-morpholine]
CID 115420704
spiro[2,3-dihydrochromene-4,3'-pyrrolidine]
CID 59233929
3,3-dibromo-2H-1-benzofuran
CID 70451620
2,3-dihydro-1,4-benzodioxine;piperazine
CID 68694467
spiro[2,3-dihydrochromene-4,4'-piperidine]
CID 10420425
spiro[1H-2-benzofuran-3,3'-pyrrolidine];hydrochloride
CID 66662035
2-fluoro-2-phenylmorpholine
CID 157082899
spiro[pyrrolidine-3,9'-xanthene]
CID 10444168
4,4-diiodo-2,3-dihydrochromene
CID 138563808
(1aR,7bS)-1a-methyl-1,2-dihydrocyclopropa[c]chromen-7b-ol
CID 164684749

Frequently Asked Questions

What is the IUPAC name of spiro[2H-1-benzofuran-3,2'-morpholine]?
The IUPAC name of spiro[2H-1-benzofuran-3,2'-morpholine] (CID 112545638) is spiro[2H-1-benzofuran-3,2'-morpholine].
What is the SMILES notation for spiro[2H-1-benzofuran-3,2'-morpholine]?
The canonical SMILES for spiro[2H-1-benzofuran-3,2'-morpholine] is c1ccc2c(c1)OCC21CNCCO1.
What is the InChIKey of spiro[2H-1-benzofuran-3,2'-morpholine]?
The InChIKey is ORGQCDNDBFWVFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c1-2-4-10-9(3-1)11(8-13-10)7-12-5-6-14-11/h1-4,12H,5-8H2.
What are the key properties of spiro[2H-1-benzofuran-3,2'-morpholine]?
spiro[2H-1-benzofuran-3,2'-morpholine] has a molecular weight of 191.23 g/mol, XLogP of 0.89, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[2H-1-benzofuran-3,2'-morpholine] is sourced from PubChem (CID 112545638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).