2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide

C14H18FN3O2 — CID 79355559

IUPAC2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide
SMILESCC1CC(=O)N(CC(=O)Nc2ccc(F)cc2)CC1N
InChIInChI=1S/C14H18FN3O2/c1-9-6-14(20)18(7-12(9)16)8-13(19)17-11-4-2-10(15)3-5-11/h2-5,9,12H,6-8,16H2,1H3,(H,17,19)
InChIKeyWJZQKCLIJWVJSB-UHFFFAOYSA-N
MW279.31 g/mol
LogP0.96
Rot. Bonds3

About 2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide

2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide (PubChem CID 79355559) has the molecular formula C14H18FN3O2 and a molecular weight of 279.31 g/mol. Its IUPAC name is 2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide
PubChem CID79355559
Molecular FormulaC14H18FN3O2
Molecular Weight279.31 g/mol
Exact Mass279.14
IUPAC Name2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide
SMILESCC1CC(=O)N(CC(=O)Nc2ccc(F)cc2)CC1N
InChIInChI=1S/C14H18FN3O2/c1-9-6-14(20)18(7-12(9)16)8-13(19)17-11-4-2-10(15)3-5-11/h2-5,9,12H,6-8,16H2,1H3,(H,17,19)
InChIKeyWJZQKCLIJWVJSB-UHFFFAOYSA-N
XLogP0.96
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide
CID 5307809
N-(4-aminophenyl)-2-(4-methyl-2-oxopyrrolidin-1-yl)acetamide
CID 63103199
N-(4-aminophenyl)-2-(4-tert-butyl-2-oxopyrrolidin-1-yl)acetamide
CID 104510942
2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(4-fluorophenyl)acetamide
CID 703778
5-amino-4-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-one
CID 79355244
N-(4-fluorophenyl)-2-[(3R)-3-methylpiperazin-1-yl]acetamide
CID 104975542
2-(3-amino-4-methylpyrrolidin-1-yl)-N-(3-chloro-4-fluorophenyl)acetamide
CID 103576696
N-(4-cyanophenyl)-2-(2-oxo-4-propan-2-ylpyrrolidin-1-yl)acetamide
CID 104511824
2-(3-amino-4-methylpyrrolidin-1-yl)-N-phenylacetamide
CID 103576964
2-[(3R)-3-aminopiperidin-1-yl]-N-(4-fluorophenyl)acetamide
CID 102977214
2-(3-aminopiperidin-1-yl)-N-(4-fluorophenyl)acetamide
CID 61297951
4-amino-N-(4-fluorophenyl)-3,5-dimethylpiperidine-1-carboxamide
CID 68909816

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide (CID 79355559) is 2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide is CC1CC(=O)N(CC(=O)Nc2ccc(F)cc2)CC1N.
What is the InChIKey of 2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide?
The InChIKey is WJZQKCLIJWVJSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3O2/c1-9-6-14(20)18(7-12(9)16)8-13(19)17-11-4-2-10(15)3-5-11/h2-5,9,12H,6-8,16H2,1H3,(H,17,19).
What are the key properties of 2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide?
2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide has a molecular weight of 279.31 g/mol, XLogP of 0.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 79355559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).