2-(6-fluoroindol-1-yl)acetic acid

C10H8FNO2 — CID 6498201

IUPAC2-(6-fluoroindol-1-yl)acetic acid
SMILESO=C(O)Cn1ccc2ccc(F)cc21
InChIInChI=1S/C10H8FNO2/c11-8-2-1-7-3-4-12(6-10(13)14)9(7)5-8/h1-5H,6H2,(H,13,14)
InChIKeyUVPVRQIYZWPBEJ-UHFFFAOYSA-N
MW193.18 g/mol
LogP1.87
Rot. Bonds2

About 2-(6-fluoroindol-1-yl)acetic acid

2-(6-fluoroindol-1-yl)acetic acid (PubChem CID 6498201) has the molecular formula C10H8FNO2 and a molecular weight of 193.18 g/mol. Its IUPAC name is 2-(6-fluoroindol-1-yl)acetic acid.

Molecular Properties

Compound Name2-(6-fluoroindol-1-yl)acetic acid
PubChem CID6498201
Molecular FormulaC10H8FNO2
Molecular Weight193.18 g/mol
Exact Mass193.05
IUPAC Name2-(6-fluoroindol-1-yl)acetic acid
SMILESO=C(O)Cn1ccc2ccc(F)cc21
InChIInChI=1S/C10H8FNO2/c11-8-2-1-7-3-4-12(6-10(13)14)9(7)5-8/h1-5H,6H2,(H,13,14)
InChIKeyUVPVRQIYZWPBEJ-UHFFFAOYSA-N
XLogP1.87
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.18
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(6-fluoroindol-1-yl)-3-phenylpropan-2-one
CID 62023949
1-(carboxymethyl)indole-6-carboxylic acid
CID 83948256
N-ethyl-2-(6-fluoroindol-1-yl)-N-methylacetamide
CID 116619982
N-benzyl-2-(6-fluoroindol-1-yl)acetamide
CID 116619757
1-[(Z)-2,3-dichloroprop-2-enyl]-6-fluoroindole
CID 116619963
2-(6-fluoroindol-1-yl)-1-(2-methylphenyl)ethanone
CID 62023950
3,3,3-trifluoro-2-[(6-fluoroindol-1-yl)methyl]propanoic acid
CID 103773362
2-(6-fluoroindol-1-yl)acetaldehyde
CID 62025779
(2R)-2-[[2-(6-fluoroindol-1-yl)acetyl]amino]-3-phenylpropanoic acid
CID 95118338
2-[[2-(6-fluoroindol-1-yl)acetyl]amino]-3-phenylpropanoic acid
CID 47001059
4-[2-(6-fluoroindol-1-yl)acetyl]piperazine-1-carbaldehyde
CID 29129372
6-(6-fluoroindol-1-yl)hexan-2-one
CID 62025777

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoroindol-1-yl)acetic acid?
The IUPAC name of 2-(6-fluoroindol-1-yl)acetic acid (CID 6498201) is 2-(6-fluoroindol-1-yl)acetic acid.
What is the SMILES notation for 2-(6-fluoroindol-1-yl)acetic acid?
The canonical SMILES for 2-(6-fluoroindol-1-yl)acetic acid is O=C(O)Cn1ccc2ccc(F)cc21.
What is the InChIKey of 2-(6-fluoroindol-1-yl)acetic acid?
The InChIKey is UVPVRQIYZWPBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO2/c11-8-2-1-7-3-4-12(6-10(13)14)9(7)5-8/h1-5H,6H2,(H,13,14).
What are the key properties of 2-(6-fluoroindol-1-yl)acetic acid?
2-(6-fluoroindol-1-yl)acetic acid has a molecular weight of 193.18 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoroindol-1-yl)acetic acid is sourced from PubChem (CID 6498201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).