N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide

C13H14FN3O3 — CID 43447518

IUPACN-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide
SMILESNc1ccc(F)c(NC(=O)CN2C(=O)CCCC2=O)c1
InChIInChI=1S/C13H14FN3O3/c14-9-5-4-8(15)6-10(9)16-11(18)7-17-12(19)2-1-3-13(17)20/h4-6H,1-3,7,15H2,(H,16,18)
InChIKeyAPARKBLCGFPVDT-UHFFFAOYSA-N
MW279.27 g/mol
LogP0.89
Rot. Bonds3

About N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide

N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide (PubChem CID 43447518) has the molecular formula C13H14FN3O3 and a molecular weight of 279.27 g/mol. Its IUPAC name is N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide
PubChem CID43447518
Molecular FormulaC13H14FN3O3
Molecular Weight279.27 g/mol
Exact Mass279.10
IUPAC NameN-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide
SMILESNc1ccc(F)c(NC(=O)CN2C(=O)CCCC2=O)c1
InChIInChI=1S/C13H14FN3O3/c14-9-5-4-8(15)6-10(9)16-11(18)7-17-12(19)2-1-3-13(17)20/h4-6H,1-3,7,15H2,(H,16,18)
InChIKeyAPARKBLCGFPVDT-UHFFFAOYSA-N
XLogP0.89
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.27
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(5-amino-2-fluorophenyl)-2-(3-methyl-2,5-dioxopyrrolidin-1-yl)acetamide
CID 61238432
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CID 80579114
N-(5-amino-2-methylphenyl)-3-(2,6-dioxopiperidin-1-yl)propanamide
CID 43447503
2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-N-(5-amino-2-fluorophenyl)acetamide
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CID 107748522
N-(5-amino-2-fluorophenyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 55237811
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N-(5-amino-2-fluorophenyl)-2-(3-hydroxypropylsulfanyl)acetamide
CID 66116080
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CID 60884491
N-(5-amino-2-fluorophenyl)-2-(4-chloro-3,5-dimethylpyrazol-1-yl)acetamide
CID 62129491
N-(5-amino-2-fluorophenyl)-2-(4-fluorophenyl)acetamide
CID 16789035
N-(5-amino-2-fluorophenyl)-2-(4-chlorophenyl)sulfanylacetamide
CID 29283740

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide?
The IUPAC name of N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide (CID 43447518) is N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide.
What is the SMILES notation for N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide?
The canonical SMILES for N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide is Nc1ccc(F)c(NC(=O)CN2C(=O)CCCC2=O)c1.
What is the InChIKey of N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide?
The InChIKey is APARKBLCGFPVDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FN3O3/c14-9-5-4-8(15)6-10(9)16-11(18)7-17-12(19)2-1-3-13(17)20/h4-6H,1-3,7,15H2,(H,16,18).
What are the key properties of N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide?
N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide has a molecular weight of 279.27 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-fluorophenyl)-2-(2,6-dioxopiperidin-1-yl)acetamide is sourced from PubChem (CID 43447518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).