N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide

C18H19FN2O2 — CID 166188945

IUPACN-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide
SMILESCCN1CCc2ccc(NC(=O)COc3ccc(F)cc3)cc21
InChIInChI=1S/C18H19FN2O2/c1-2-21-10-9-13-3-6-15(11-17(13)21)20-18(22)12-23-16-7-4-14(19)5-8-16/h3-8,11H,2,9-10,12H2,1H3,(H,20,22)
InChIKeyBVWCIYJPSKJZMC-UHFFFAOYSA-N
MW314.36 g/mol
LogP3.23
Rot. Bonds5

About N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide

N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide (PubChem CID 166188945) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide
PubChem CID166188945
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC NameN-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide
SMILESCCN1CCc2ccc(NC(=O)COc3ccc(F)cc3)cc21
InChIInChI=1S/C18H19FN2O2/c1-2-21-10-9-13-3-6-15(11-17(13)21)20-18(22)12-23-16-7-4-14(19)5-8-16/h3-8,11H,2,9-10,12H2,1H3,(H,20,22)
InChIKeyBVWCIYJPSKJZMC-UHFFFAOYSA-N
XLogP3.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(4-fluorophenoxy)acetamide
CID 16942902
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide
CID 18206710
tert-butyl 7-[[2-(4-fluorophenoxy)acetyl]amino]-3,4-dihydro-1H-isoquinoline-2-carboxylate
CID 166201712
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-phenoxyacetamide
CID 7527152
N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-2-phenoxyacetamide
CID 18565135
N-(4-ethylphenyl)-2-(4-fluorophenoxy)acetamide
CID 893586
2-(4-butoxyphenoxy)-N-(4-fluorophenyl)acetamide
CID 4732741
N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(4-fluorophenoxy)acetamide
CID 16930802
N-[4-(4-acetylpiperazin-1-yl)phenyl]-2-(4-fluorophenoxy)acetamide
CID 110673105
2-(4-fluorophenoxy)-N-(3-hydroxyphenyl)acetamide
CID 6458581
3-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(1-ethyl-2,3-dihydroindol-6-yl)butanamide
CID 84594643
N-(4-ethoxyphenyl)-4-[[2-(4-fluorophenoxy)acetyl]amino]benzamide
CID 26218143

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide?
The IUPAC name of N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide (CID 166188945) is N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide.
What is the SMILES notation for N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide?
The canonical SMILES for N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide is CCN1CCc2ccc(NC(=O)COc3ccc(F)cc3)cc21.
What is the InChIKey of N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide?
The InChIKey is BVWCIYJPSKJZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c1-2-21-10-9-13-3-6-15(11-17(13)21)20-18(22)12-23-16-7-4-14(19)5-8-16/h3-8,11H,2,9-10,12H2,1H3,(H,20,22).
What are the key properties of N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide?
N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide has a molecular weight of 314.36 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide is sourced from PubChem (CID 166188945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).