N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide

C17H15FN2O2 — CID 113206274

IUPACN-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1c[nH]c2cc(F)ccc12
InChIInChI=1S/C17H15FN2O2/c1-2-22-16-6-4-3-5-14(16)20-17(21)13-10-19-15-9-11(18)7-8-12(13)15/h3-10,19H,2H2,1H3,(H,20,21)
InChIKeyXFWBFRCGVZGIGW-UHFFFAOYSA-N
MW298.32 g/mol
LogP3.96
Rot. Bonds4

About N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide

N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide (PubChem CID 113206274) has the molecular formula C17H15FN2O2 and a molecular weight of 298.32 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide
PubChem CID113206274
Molecular FormulaC17H15FN2O2
Molecular Weight298.32 g/mol
Exact Mass298.11
IUPAC NameN-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1c[nH]c2cc(F)ccc12
InChIInChI=1S/C17H15FN2O2/c1-2-22-16-6-4-3-5-14(16)20-17(21)13-10-19-15-9-11(18)7-8-12(13)15/h3-10,19H,2H2,1H3,(H,20,21)
InChIKeyXFWBFRCGVZGIGW-UHFFFAOYSA-N
XLogP3.96
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.32
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethoxyphenyl)-5-methoxy-1H-indole-3-carboxamide
CID 113206077
2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide
CID 2591172
N-(2,6-diethylphenyl)-6-fluoro-1H-indole-3-carboxamide
CID 113206252
6-amino-N-(2-methoxyphenyl)-1H-indole-3-carboxamide
CID 61089726
N-(2,4-dimethylphenyl)-6-fluoro-1H-indole-3-carboxamide
CID 113206239
N-(2-ethoxyphenyl)-5-fluoro-1H-indole-2-carboxamide
CID 113207170
N-(2-ethoxyphenyl)-2-iodobenzamide
CID 996130
6-fluoro-1H-indole-3-carbohydrazide
CID 129321028
N-(4-ethoxyphenyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208671
N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide
CID 16650861
6-fluoro-N-(2-morpholin-4-ylphenyl)-1H-indole-3-carboxamide
CID 113206299
2,4-diethoxy-N-(2-ethoxyphenyl)benzamide
CID 17340647

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide (CID 113206274) is N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide is CCOc1ccccc1NC(=O)c1c[nH]c2cc(F)ccc12.
What is the InChIKey of N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide?
The InChIKey is XFWBFRCGVZGIGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O2/c1-2-22-16-6-4-3-5-14(16)20-17(21)13-10-19-15-9-11(18)7-8-12(13)15/h3-10,19H,2H2,1H3,(H,20,21).
What are the key properties of N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide?
N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide has a molecular weight of 298.32 g/mol, XLogP of 3.96, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide is sourced from PubChem (CID 113206274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).