N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide

C18H16FN3O2 — CID 110861296

IUPACN-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)Cc2c[nH]c3cc(F)ccc23)c1
InChIInChI=1S/C18H16FN3O2/c1-11(23)21-14-3-2-4-15(9-14)22-18(24)7-12-10-20-17-8-13(19)5-6-16(12)17/h2-6,8-10,20H,7H2,1H3,(H,21,23)(H,22,24)
InChIKeyBMVCJUHEOZFRID-UHFFFAOYSA-N
MW325.34 g/mol
LogP3.45
Rot. Bonds4

About N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide

N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide (PubChem CID 110861296) has the molecular formula C18H16FN3O2 and a molecular weight of 325.34 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
PubChem CID110861296
Molecular FormulaC18H16FN3O2
Molecular Weight325.34 g/mol
Exact Mass325.12
IUPAC NameN-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)Cc2c[nH]c3cc(F)ccc23)c1
InChIInChI=1S/C18H16FN3O2/c1-11(23)21-14-3-2-4-15(9-14)22-18(24)7-12-10-20-17-8-13(19)5-6-16(12)17/h2-6,8-10,20H,7H2,1H3,(H,21,23)(H,22,24)
InChIKeyBMVCJUHEOZFRID-UHFFFAOYSA-N
XLogP3.45
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.34
LogP ≤ 53.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-acetylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 110861017
N-(4-bromo-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 113209477
methyl 4-[[2-(6-fluoro-1H-indol-3-yl)acetyl]amino]benzoate
CID 113209461
N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 86877960
methyl 2-chloro-4-[[2-(6-fluoro-1H-indol-3-yl)acetyl]amino]benzoate
CID 172548040
2-(5-fluoro-1H-indol-3-yl)-N-[3-(hydroxymethyl)phenyl]acetamide
CID 111393023
2-(1H-indol-3-yl)-N-[3-(methylcarbamoylamino)phenyl]acetamide
CID 38160633
2-[[2-(6-fluoro-1H-indol-3-yl)acetyl]amino]-2-methylpropanoic acid
CID 119187887
2-(6-fluoro-1H-indol-3-yl)-N-(1-phenylethyl)acetamide
CID 113209373
N-(3-acetamidophenyl)-2-(4,5,6-trimethoxy-1H-indol-3-yl)acetamide
CID 113211325
N-[2-(dimethylamino)ethyl]-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 113209367
4-(6-fluoro-1H-indol-3-yl)butan-2-one
CID 28806457

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide (CID 110861296) is N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide is CC(=O)Nc1cccc(NC(=O)Cc2c[nH]c3cc(F)ccc23)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide?
The InChIKey is BMVCJUHEOZFRID-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN3O2/c1-11(23)21-14-3-2-4-15(9-14)22-18(24)7-12-10-20-17-8-13(19)5-6-16(12)17/h2-6,8-10,20H,7H2,1H3,(H,21,23)(H,22,24).
What are the key properties of N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide?
N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide has a molecular weight of 325.34 g/mol, XLogP of 3.45, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide is sourced from PubChem (CID 110861296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).