(3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol

C11H12FNO2 — CID 167078390

IUPAC(3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol
SMILESCN1c2ccc(O)cc2[C@]2(F)CCO[C@H]12
InChIInChI=1S/C11H12FNO2/c1-13-9-3-2-7(14)6-8(9)11(12)4-5-15-10(11)13/h2-3,6,10,14H,4-5H2,1H3/t10-,11+/m0/s1
InChIKeyBSNIVHXCDRBKBU-WDEREUQCSA-N
MW209.22 g/mol
LogP1.75
Rot. Bonds

About (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol

(3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol (PubChem CID 167078390) has the molecular formula C11H12FNO2 and a molecular weight of 209.22 g/mol. Its IUPAC name is (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol.

Molecular Properties

Compound Name(3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol
PubChem CID167078390
Molecular FormulaC11H12FNO2
Molecular Weight209.22 g/mol
Exact Mass209.09
IUPAC Name(3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol
SMILESCN1c2ccc(O)cc2[C@]2(F)CCO[C@H]12
InChIInChI=1S/C11H12FNO2/c1-13-9-3-2-7(14)6-8(9)11(12)4-5-15-10(11)13/h2-3,6,10,14H,4-5H2,1H3/t10-,11+/m0/s1
InChIKeyBSNIVHXCDRBKBU-WDEREUQCSA-N
XLogP1.75
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol with MolForge

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Related Compounds

3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol
CID 1250
(8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol;(E)-but-2-enedioic acid
CID 45105103
bis((3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol);(E)-but-2-enedioic acid
CID 160561071
2,7-dimethyl-5-oxa-7,10-diazatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene
CID 166446193
(9R)-1,10-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol
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(1S,9R,10R)-17-methyl-11-oxa-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol
CID 90679801
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CID 105494683
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CID 90901779
6-fluoro-1-methylspiro[2H-3,1-benzoxazine-4,4'-piperidine]-2-ol
CID 174584995
(1S,9S)-1,10-dimethyl-10-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-ol
CID 11183301
(1R,13R)-1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-triene-4,13-diol
CID 90679099
ethane;propane;1,1,3,3-tetramethyl-2H-inden-5-ol
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Frequently Asked Questions

What is the IUPAC name of (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol?
The IUPAC name of (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol (CID 167078390) is (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol.
What is the SMILES notation for (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol?
The canonical SMILES for (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol is CN1c2ccc(O)cc2[C@]2(F)CCO[C@H]12.
What is the InChIKey of (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol?
The InChIKey is BSNIVHXCDRBKBU-WDEREUQCSA-N. The full InChI is InChI=1S/C11H12FNO2/c1-13-9-3-2-7(14)6-8(9)11(12)4-5-15-10(11)13/h2-3,6,10,14H,4-5H2,1H3/t10-,11+/m0/s1.
What are the key properties of (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol?
(3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol has a molecular weight of 209.22 g/mol, XLogP of 1.75, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3aS,8bR)-8b-fluoro-4-methyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-ol is sourced from PubChem (CID 167078390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).