spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane]

C8H9NOS — CID 82377297

IUPACspiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane]
SMILESc1cc2c(o1)NCC1(CC1)S2
InChIInChI=1S/C8H9NOS/c1-4-10-7-6(1)11-8(2-3-8)5-9-7/h1,4,9H,2-3,5H2
InChIKeyGNRIFFWKBKKCBE-UHFFFAOYSA-N
MW167.23 g/mol
LogP2.33
Rot. Bonds

About spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane]

spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane] (PubChem CID 82377297) has the molecular formula C8H9NOS and a molecular weight of 167.23 g/mol. Its IUPAC name is spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane].

Molecular Properties

Compound Namespiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane]
PubChem CID82377297
Molecular FormulaC8H9NOS
Molecular Weight167.23 g/mol
Exact Mass167.04
IUPAC Namespiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane]
SMILESc1cc2c(o1)NCC1(CC1)S2
InChIInChI=1S/C8H9NOS/c1-4-10-7-6(1)11-8(2-3-8)5-9-7/h1,4,9H,2-3,5H2
InChIKeyGNRIFFWKBKKCBE-UHFFFAOYSA-N
XLogP2.33
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.23
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane] with MolForge

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Related Compounds

2,3-dihydrofuro[2,3-d][1,3]thiazole
CID 58996043
5-fluorospiro[3,4-dihydro-1,4-benzothiazine-2,1'-cyclopropane]
CID 115096974
5-methylspiro[3,4-dihydro-1,4-benzothiazine-2,1'-cyclopropane]
CID 115096973
7-methylspiro[3,4-dihydro-1,4-benzothiazine-2,1'-cyclopropane]
CID 115097143
spiro[3,4-dihydro-1,4-benzothiazine-2,1'-cyclopropane]-6-ol
CID 115097061
spiro[3,4-dihydro-1,4-benzothiazine-2,1'-cyclobutane]-5-ol
CID 115097342
spiro[3,4-dihydro-1,4-benzothiazine-2,1'-cyclopentane]
CID 115097599
5-fluorospiro[3,4-dihydro-1,4-benzothiazine-2,1'-cyclohexane]
CID 115098008
7-chlorospiro[3,4-dihydro-1,4-benzothiazine-2,1'-cyclopentane]
CID 115097844
6-methylspiro[3,4-dihydropyrrolo[3,4-b][1,4]thiazine-2,1'-cyclopropane]-5-carboxylic acid
CID 82377721
7-(trifluoromethyl)spiro[3,4-dihydro-1,4-benzothiazine-2,1'-cyclobutane]
CID 115097511
2-oxa-6-thiabicyclo[3.2.0]hepta-1(5),3-diene
CID 175973605

Frequently Asked Questions

What is the IUPAC name of spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane]?
The IUPAC name of spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane] (CID 82377297) is spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane].
What is the SMILES notation for spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane]?
The canonical SMILES for spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane] is c1cc2c(o1)NCC1(CC1)S2.
What is the InChIKey of spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane]?
The InChIKey is GNRIFFWKBKKCBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NOS/c1-4-10-7-6(1)11-8(2-3-8)5-9-7/h1,4,9H,2-3,5H2.
What are the key properties of spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane]?
spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane] has a molecular weight of 167.23 g/mol, XLogP of 2.33, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[3,4-dihydrofuro[3,2-b][1,4]thiazine-2,1'-cyclopropane] is sourced from PubChem (CID 82377297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).