N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide

C16H14FN3O — CID 43611958

IUPACN-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide
SMILESNc1ccc(F)cc1NC(=O)Cn1ccc2ccccc21
InChIInChI=1S/C16H14FN3O/c17-12-5-6-13(18)14(9-12)19-16(21)10-20-8-7-11-3-1-2-4-15(11)20/h1-9H,10,18H2,(H,19,21)
InChIKeyBDKYZZRHXRJBLQ-UHFFFAOYSA-N
MW283.31 g/mol
LogP3.00
Rot. Bonds3

About N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide

N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide (PubChem CID 43611958) has the molecular formula C16H14FN3O and a molecular weight of 283.31 g/mol. Its IUPAC name is N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide.

Molecular Properties

Compound NameN-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide
PubChem CID43611958
Molecular FormulaC16H14FN3O
Molecular Weight283.31 g/mol
Exact Mass283.11
IUPAC NameN-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide
SMILESNc1ccc(F)cc1NC(=O)Cn1ccc2ccccc21
InChIInChI=1S/C16H14FN3O/c17-12-5-6-13(18)14(9-12)19-16(21)10-20-8-7-11-3-1-2-4-15(11)20/h1-9H,10,18H2,(H,19,21)
InChIKeyBDKYZZRHXRJBLQ-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-(3-amino-2-methylphenyl)-2-indol-1-ylacetamide
CID 43247265
N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide
CID 9209396
N-(3-amino-4-chlorophenyl)-2-indol-1-ylacetamide
CID 43134811
2-(6-fluoroindol-1-yl)-N-(3-indol-1-ylpropyl)acetamide
CID 166330830
N-(2-aminophenyl)-2-(4-fluoroindol-1-yl)acetamide
CID 82782601
2-amino-N-(2-amino-5-fluorophenyl)acetamide
CID 110477650
N-(2-amino-5-fluorophenyl)-2-(6-oxopyridazin-1-yl)acetamide
CID 55126633
N-(2-amino-6-methylphenyl)-2-indol-1-ylacetamide
CID 43376298
2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide
CID 100743004
N-(2-chloro-4-fluorophenyl)-2-(1-oxoisoquinolin-2-yl)acetamide
CID 9354365
5-[(2-indol-1-ylacetyl)amino]-2,4-dimethylbenzoic acid
CID 138043722
N-(3,5-difluoro-4-methoxyphenyl)-2-indol-1-ylacetamide
CID 87042646

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide?
The IUPAC name of N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide (CID 43611958) is N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide.
What is the SMILES notation for N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide?
The canonical SMILES for N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide is Nc1ccc(F)cc1NC(=O)Cn1ccc2ccccc21.
What is the InChIKey of N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide?
The InChIKey is BDKYZZRHXRJBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O/c17-12-5-6-13(18)14(9-12)19-16(21)10-20-8-7-11-3-1-2-4-15(11)20/h1-9H,10,18H2,(H,19,21).
What are the key properties of N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide?
N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide 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-amino-5-fluorophenyl)-2-indol-1-ylacetamide is sourced from PubChem (CID 43611958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).