1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone

C17H14FNO — CID 62025038

IUPAC1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone
SMILESCc1ccc2ccn(CC(=O)c3ccccc3F)c2c1
InChIInChI=1S/C17H14FNO/c1-12-6-7-13-8-9-19(16(13)10-12)11-17(20)14-4-2-3-5-15(14)18/h2-10H,11H2,1H3
InChIKeyCZNVLOCNDUVDIR-UHFFFAOYSA-N
MW267.30 g/mol
LogP3.97
Rot. Bonds3

About 1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone

1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone (PubChem CID 62025038) has the molecular formula C17H14FNO and a molecular weight of 267.30 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone.

Molecular Properties

Compound Name1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone
PubChem CID62025038
Molecular FormulaC17H14FNO
Molecular Weight267.30 g/mol
Exact Mass267.11
IUPAC Name1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone
SMILESCc1ccc2ccn(CC(=O)c3ccccc3F)c2c1
InChIInChI=1S/C17H14FNO/c1-12-6-7-13-8-9-19(16(13)10-12)11-17(20)14-4-2-3-5-15(14)18/h2-10H,11H2,1H3
InChIKeyCZNVLOCNDUVDIR-UHFFFAOYSA-N
XLogP3.97
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone?
The IUPAC name of 1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone (CID 62025038) is 1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone.
What is the SMILES notation for 1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone?
The canonical SMILES for 1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone is Cc1ccc2ccn(CC(=O)c3ccccc3F)c2c1.
What is the InChIKey of 1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone?
The InChIKey is CZNVLOCNDUVDIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO/c1-12-6-7-13-8-9-19(16(13)10-12)11-17(20)14-4-2-3-5-15(14)18/h2-10H,11H2,1H3.
What are the key properties of 1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone?
1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone has a molecular weight of 267.30 g/mol, XLogP of 3.97, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone is sourced from PubChem (CID 62025038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).