N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide

C16H11ClF2N2O — CID 113209314

IUPACN-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccc(F)cc12)Nc1ccc(F)c(Cl)c1
InChIInChI=1S/C16H11ClF2N2O/c17-13-7-11(2-3-14(13)19)21-16(22)5-9-8-20-15-4-1-10(18)6-12(9)15/h1-4,6-8,20H,5H2,(H,21,22)
InChIKeySWSFWQKYFVNOJM-UHFFFAOYSA-N
MW320.73 g/mol
LogP4.28
Rot. Bonds3

About N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide

N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide (PubChem CID 113209314) has the molecular formula C16H11ClF2N2O and a molecular weight of 320.73 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide
PubChem CID113209314
Molecular FormulaC16H11ClF2N2O
Molecular Weight320.73 g/mol
Exact Mass320.05
IUPAC NameN-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccc(F)cc12)Nc1ccc(F)c(Cl)c1
InChIInChI=1S/C16H11ClF2N2O/c17-13-7-11(2-3-14(13)19)21-16(22)5-9-8-20-15-4-1-10(18)6-12(9)15/h1-4,6-8,20H,5H2,(H,21,22)
InChIKeySWSFWQKYFVNOJM-UHFFFAOYSA-N
XLogP4.28
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.73
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-(5-fluoro-1H-indol-3-yl)-N-[3-(hydroxymethyl)phenyl]acetamide
CID 111393023
N-[4-(diethylamino)phenyl]-2-(5-fluoro-1H-indol-3-yl)acetamide
CID 113209328
N-[2-(2,4-dichlorophenyl)ethyl]-2-(5-fluoro-1H-indol-3-yl)acetamide
CID 113209285
methyl 2-chloro-4-[[2-(6-fluoro-1H-indol-3-yl)acetyl]amino]benzoate
CID 172548040
1-(3-chloro-4-fluorophenyl)-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea
CID 8767861
N-[6-(3-chloro-4-fluoroanilino)pyridazin-3-yl]-2-(1H-indol-3-yl)acetamide
CID 113047833
N-(3-chloro-4-fluorophenyl)-2-phenylacetamide
CID 871803
N-(2-aminoethyl)-2-(5-fluoro-1H-indol-3-yl)acetamide
CID 110833777
N-(4-bromo-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 113209477
2-(5-fluoro-1H-indol-3-yl)-N-propan-2-ylacetamide
CID 110700223
2-[[2-(5-fluoro-1H-indol-3-yl)acetyl]amino]benzamide
CID 110700282
2-(5-fluoro-1H-indol-3-yl)-N-propylacetamide
CID 110700222

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide (CID 113209314) is N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide is O=C(Cc1c[nH]c2ccc(F)cc12)Nc1ccc(F)c(Cl)c1.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide?
The InChIKey is SWSFWQKYFVNOJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClF2N2O/c17-13-7-11(2-3-14(13)19)21-16(22)5-9-8-20-15-4-1-10(18)6-12(9)15/h1-4,6-8,20H,5H2,(H,21,22).
What are the key properties of N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide?
N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide has a molecular weight of 320.73 g/mol, XLogP of 4.28, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide is sourced from PubChem (CID 113209314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).