2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide

C17H14F2N2O — CID 110851272

IUPAC2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide
SMILESO=C(Cc1c[nH]c2c(F)cccc12)NCc1ccc(F)cc1
InChIInChI=1S/C17H14F2N2O/c18-13-6-4-11(5-7-13)9-20-16(22)8-12-10-21-17-14(12)2-1-3-15(17)19/h1-7,10,21H,8-9H2,(H,20,22)
InChIKeyPSPZZBMHOCFYNW-UHFFFAOYSA-N
MW300.31 g/mol
LogP3.31
Rot. Bonds4

About 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide

2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide (PubChem CID 110851272) has the molecular formula C17H14F2N2O and a molecular weight of 300.31 g/mol. Its IUPAC name is 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide
PubChem CID110851272
Molecular FormulaC17H14F2N2O
Molecular Weight300.31 g/mol
Exact Mass300.11
IUPAC Name2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide
SMILESO=C(Cc1c[nH]c2c(F)cccc12)NCc1ccc(F)cc1
InChIInChI=1S/C17H14F2N2O/c18-13-6-4-11(5-7-13)9-20-16(22)8-12-10-21-17-14(12)2-1-3-15(17)19/h1-7,10,21H,8-9H2,(H,20,22)
InChIKeyPSPZZBMHOCFYNW-UHFFFAOYSA-N
XLogP3.31
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-amino-2-methylpropyl)-2-(7-fluoro-1H-indol-3-yl)acetamide
CID 110833834
N-[(4-fluorophenyl)methyl]-2-(5-methyl-1H-pyrrol-3-yl)acetamide
CID 112528395
7-fluoro-N-[(4-fluorophenyl)methyl]-2-methyl-1H-indole-3-carboxamide
CID 110851268
2-(2,6-difluorophenyl)-N-[[4-(hydroxymethyl)phenyl]methyl]acetamide
CID 107231725
N-[(2-fluorophenyl)methyl]-2-(1H-indol-3-yl)acetamide
CID 3562962
2-(4-fluorophenyl)-N-[(3-hydroxyphenyl)methyl]acetamide
CID 47292141
N-[[4-(bromomethyl)phenyl]methyl]-2-(2,6-difluorophenyl)acetamide
CID 107233811
2-[[2-(7-fluoro-1H-indol-3-yl)acetyl]-methylamino]acetic acid
CID 110835994
N-benzyl-N'-[(4-fluorophenyl)methyl]butanediamide
CID 91939014
N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide
CID 25142685
2-chloro-N-[(4-fluorophenyl)methyl]acetamide
CID 2303709
3-[(4-fluorophenyl)methylamino]-3-oxopropanoic acid
CID 62230048

Frequently Asked Questions

What is the IUPAC name of 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide?
The IUPAC name of 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide (CID 110851272) is 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide.
What is the SMILES notation for 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide?
The canonical SMILES for 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide is O=C(Cc1c[nH]c2c(F)cccc12)NCc1ccc(F)cc1.
What is the InChIKey of 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide?
The InChIKey is PSPZZBMHOCFYNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F2N2O/c18-13-6-4-11(5-7-13)9-20-16(22)8-12-10-21-17-14(12)2-1-3-15(17)19/h1-7,10,21H,8-9H2,(H,20,22).
What are the key properties of 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide?
2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide has a molecular weight of 300.31 g/mol, XLogP of 3.31, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 110851272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).