5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid

C11H9NO3 — CID 96619137

IUPAC5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid
SMILESO=C(O)c1cc2c(o1)-c1cc[nH]c1CC2
InChIInChI=1S/C11H9NO3/c13-11(14)9-5-6-1-2-8-7(3-4-12-8)10(6)15-9/h3-5,12H,1-2H2,(H,13,14)
InChIKeyWSQSYXLLZVSUDL-UHFFFAOYSA-N
MW203.20 g/mol
LogP2.07
Rot. Bonds1

About 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid

5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid (PubChem CID 96619137) has the molecular formula C11H9NO3 and a molecular weight of 203.20 g/mol. Its IUPAC name is 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid.

Molecular Properties

Compound Name5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid
PubChem CID96619137
Molecular FormulaC11H9NO3
Molecular Weight203.20 g/mol
Exact Mass203.06
IUPAC Name5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid
SMILESO=C(O)c1cc2c(o1)-c1cc[nH]c1CC2
InChIInChI=1S/C11H9NO3/c13-11(14)9-5-6-1-2-8-7(3-4-12-8)10(6)15-9/h3-5,12H,1-2H2,(H,13,14)
InChIKeyWSQSYXLLZVSUDL-UHFFFAOYSA-N
XLogP2.07
TPSA66.23 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-oxa-7,12-diazatricyclo[7.3.0.02,6]dodeca-1(9),2(6),4,10-tetraene-4-carboxylic acid
CID 96618736
11-methyl-3-oxa-7,10-diazatricyclo[7.3.0.02,6]dodeca-1(9),2(6),4,11-tetraene-4-carboxylic acid
CID 96610254
4,9-dioxobenzo[f][1]benzofuran-2-carboxylic acid
CID 58260130
4,6-dihydrothieno[3,4-b]furan-2-carboxylic acid
CID 84765754
5-(1,2-dihydroacenaphthylen-5-yl)furan-2-carboxylic acid
CID 114939422
lithium;hydride;6-methyl-5,7-dihydro-4H-furo[2,3-c]pyridine-2-carboxylic acid
CID 173173809
4,5-dihydro-3H-benzo[e]indole-1-carboxylic acid
CID 69379153
furan-2,5-dicarboxylic acid;indigane
CID 174700126
4-(3-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxylic acid
CID 58064799
tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaene-5,12-dicarboxylic acid
CID 4072199
5-[(2-oxo-1,5,6,7,8,9-hexahydrocyclohepta[b]pyridine-3-carbonyl)amino]-1-benzofuran-2-carboxylic acid
CID 120690723
anilino 1,4,5,7-tetrahydropyrrolo[2,3-c]pyridine-6-carboxylate
CID 129246616

Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid?
The IUPAC name of 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid (CID 96619137) is 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid.
What is the SMILES notation for 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid?
The canonical SMILES for 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid is O=C(O)c1cc2c(o1)-c1cc[nH]c1CC2.
What is the InChIKey of 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid?
The InChIKey is WSQSYXLLZVSUDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO3/c13-11(14)9-5-6-1-2-8-7(3-4-12-8)10(6)15-9/h3-5,12H,1-2H2,(H,13,14).
What are the key properties of 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid?
5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid has a molecular weight of 203.20 g/mol, XLogP of 2.07, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-4H-furo[2,3-e]indole-2-carboxylic acid is sourced from PubChem (CID 96619137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).