N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide

C19H17FN2O2 — CID 955255

IUPACN-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide
SMILESCCC(=O)c1cn(CC(=O)Nc2ccccc2F)c2ccccc12
InChIInChI=1S/C19H17FN2O2/c1-2-18(23)14-11-22(17-10-6-3-7-13(14)17)12-19(24)21-16-9-5-4-8-15(16)20/h3-11H,2,12H2,1H3,(H,21,24)
InChIKeyVLYSKKBXAFTPKA-UHFFFAOYSA-N
MW324.36 g/mol
LogP4.01
Rot. Bonds5

About N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide

N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide (PubChem CID 955255) has the molecular formula C19H17FN2O2 and a molecular weight of 324.36 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide
PubChem CID955255
Molecular FormulaC19H17FN2O2
Molecular Weight324.36 g/mol
Exact Mass324.13
IUPAC NameN-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide
SMILESCCC(=O)c1cn(CC(=O)Nc2ccccc2F)c2ccccc12
InChIInChI=1S/C19H17FN2O2/c1-2-18(23)14-11-22(17-10-6-3-7-13(14)17)12-19(24)21-16-9-5-4-8-15(16)20/h3-11H,2,12H2,1H3,(H,21,24)
InChIKeyVLYSKKBXAFTPKA-UHFFFAOYSA-N
XLogP4.01
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide (CID 955255) is N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide is CCC(=O)c1cn(CC(=O)Nc2ccccc2F)c2ccccc12.
What is the InChIKey of N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide?
The InChIKey is VLYSKKBXAFTPKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O2/c1-2-18(23)14-11-22(17-10-6-3-7-13(14)17)12-19(24)21-16-9-5-4-8-15(16)20/h3-11H,2,12H2,1H3,(H,21,24).
What are the key properties of N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide?
N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide has a molecular weight of 324.36 g/mol, XLogP of 4.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-(3-propanoylindol-1-yl)acetamide is sourced from PubChem (CID 955255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).