N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide

C16H14FN3O — CID 82782601

IUPACN-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide
SMILESNc1ccccc1NC(=O)Cn1ccc2c(F)cccc21
InChIInChI=1S/C16H14FN3O/c17-12-4-3-7-15-11(12)8-9-20(15)10-16(21)19-14-6-2-1-5-13(14)18/h1-9H,10,18H2,(H,19,21)
InChIKeyHEHJVITYTHZRFX-UHFFFAOYSA-N
MW283.31 g/mol
LogP3.00
Rot. Bonds3

About N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide

N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide (PubChem CID 82782601) has the molecular formula C16H14FN3O and a molecular weight of 283.31 g/mol. Its IUPAC name is N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide
PubChem CID82782601
Molecular FormulaC16H14FN3O
Molecular Weight283.31 g/mol
Exact Mass283.11
IUPAC NameN-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide
SMILESNc1ccccc1NC(=O)Cn1ccc2c(F)cccc21
InChIInChI=1S/C16H14FN3O/c17-12-4-3-7-15-11(12)8-9-20(15)10-16(21)19-14-6-2-1-5-13(14)18/h1-9H,10,18H2,(H,19,21)
InChIKeyHEHJVITYTHZRFX-UHFFFAOYSA-N
XLogP3.00
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-aminophenyl)-2-(2,6-difluorophenoxy)acetamide
CID 81268833
N-(3-amino-2-methylphenyl)-2-indol-1-ylacetamide
CID 43247265
1-(4-fluoroindol-1-yl)-3-(2-fluorophenyl)propan-2-one
CID 82782618
N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide
CID 43611958
N-(2-aminophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 62962477
N-(3-chloro-2-fluorophenyl)-2-(4-oxoquinolin-1-yl)acetamide
CID 47780650
N-(2-aminophenyl)-2-(3-bromo-2-oxo-1-pyridinyl)acetamide
CID 114760013
2-(4-aminoindol-1-yl)-N-[1-(3,5-difluorophenyl)cyclopropyl]acetamide
CID 167875853
N-(2-hydroxyphenyl)-2-(4-oxoquinolin-1-yl)acetamide
CID 47840872
N,N-diethyl-2-(4-fluoroindol-1-yl)acetamide
CID 82794493
2-[[2-(2-aminoanilino)-2-oxoethyl]amino]-N-(2-aminophenyl)acetamide
CID 102158017
N-(3-fluoro-2-methylphenyl)-2-(3-formylindol-1-yl)acetamide
CID 5077099

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide?
The IUPAC name of N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide (CID 82782601) is N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide.
What is the SMILES notation for N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide?
The canonical SMILES for N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide is Nc1ccccc1NC(=O)Cn1ccc2c(F)cccc21.
What is the InChIKey of N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide?
The InChIKey is HEHJVITYTHZRFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O/c17-12-4-3-7-15-11(12)8-9-20(15)10-16(21)19-14-6-2-1-5-13(14)18/h1-9H,10,18H2,(H,19,21).
What are the key properties of N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide?
N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide has a molecular weight of 283.31 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide is sourced from PubChem (CID 82782601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).