1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide

C15H20FN3O2 — CID 8531194

IUPAC1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide
SMILESCc1ccc(NC(=O)CN2CCC(C(N)=O)CC2)c(F)c1
InChIInChI=1S/C15H20FN3O2/c1-10-2-3-13(12(16)8-10)18-14(20)9-19-6-4-11(5-7-19)15(17)21/h2-3,8,11H,4-7,9H2,1H3,(H2,17,21)(H,18,20)
InChIKeyXXEUESSCHYDFGU-UHFFFAOYSA-N
MW293.34 g/mol
LogP1.27
Rot. Bonds4

About 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide

1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide (PubChem CID 8531194) has the molecular formula C15H20FN3O2 and a molecular weight of 293.34 g/mol. Its IUPAC name is 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide
PubChem CID8531194
Molecular FormulaC15H20FN3O2
Molecular Weight293.34 g/mol
Exact Mass293.15
IUPAC Name1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide
SMILESCc1ccc(NC(=O)CN2CCC(C(N)=O)CC2)c(F)c1
InChIInChI=1S/C15H20FN3O2/c1-10-2-3-13(12(16)8-10)18-14(20)9-19-6-4-11(5-7-19)15(17)21/h2-3,8,11H,4-7,9H2,1H3,(H2,17,21)(H,18,20)
InChIKeyXXEUESSCHYDFGU-UHFFFAOYSA-N
XLogP1.27
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(2-amino-4-fluoroanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 16792068
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(2-fluoro-4-methylphenyl)acetamide
CID 120776716
ethyl 1-[2-(2,4-difluoroanilino)-2-oxoethyl]piperidine-4-carboxylate
CID 4818400
N-(2-fluoro-4-methylphenyl)-2-(2-methylpiperidin-1-yl)acetamide
CID 17403289
2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-N-(2-fluoro-4-methylphenyl)acetamide
CID 9390252
N-(2-fluoro-4-methylphenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 8583449
N-(2-fluoro-4-methylphenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8691168
1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 8531166
N-(2-amino-4-methylphenyl)-2-(4-propan-2-ylpiperidin-1-yl)acetamide
CID 103505292
(3S)-1-[2-(2,4-difluoroanilino)-2-oxoethyl]piperidine-3-carboxamide
CID 9305453
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(2-bromo-4-methylphenyl)acetamide
CID 63595023
N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide
CID 171701345

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide (CID 8531194) is 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide is Cc1ccc(NC(=O)CN2CCC(C(N)=O)CC2)c(F)c1.
What is the InChIKey of 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide?
The InChIKey is XXEUESSCHYDFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN3O2/c1-10-2-3-13(12(16)8-10)18-14(20)9-19-6-4-11(5-7-19)15(17)21/h2-3,8,11H,4-7,9H2,1H3,(H2,17,21)(H,18,20).
What are the key properties of 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide?
1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide has a molecular weight of 293.34 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide is sourced from PubChem (CID 8531194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).