N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide

C21H24ClN3O2 — CID 16589818

IUPACN-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide
SMILESO=C(CN1CCC(NC(=O)Cc2ccc(Cl)cc2)CC1)Nc1ccccc1
InChIInChI=1S/C21H24ClN3O2/c22-17-8-6-16(7-9-17)14-20(26)23-19-10-12-25(13-11-19)15-21(27)24-18-4-2-1-3-5-18/h1-9,19H,10-15H2,(H,23,26)(H,24,27)
InChIKeyRNEOKIPWUIFQFZ-UHFFFAOYSA-N
MW385.89 g/mol
LogP3.10
Rot. Bonds6

About N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide

N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide (PubChem CID 16589818) has the molecular formula C21H24ClN3O2 and a molecular weight of 385.89 g/mol. Its IUPAC name is N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide
PubChem CID16589818
Molecular FormulaC21H24ClN3O2
Molecular Weight385.89 g/mol
Exact Mass385.16
IUPAC NameN-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide
SMILESO=C(CN1CCC(NC(=O)Cc2ccc(Cl)cc2)CC1)Nc1ccccc1
InChIInChI=1S/C21H24ClN3O2/c22-17-8-6-16(7-9-17)14-20(26)23-19-10-12-25(13-11-19)15-21(27)24-18-4-2-1-3-5-18/h1-9,19H,10-15H2,(H,23,26)(H,24,27)
InChIKeyRNEOKIPWUIFQFZ-UHFFFAOYSA-N
XLogP3.10
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.89
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-1-(4-chlorophenyl)cyclopropane-1-carboxamide
CID 42047243
4-amino-N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]butanamide;dihydrochloride
CID 119840358
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(2-methoxyphenyl)acetamide
CID 16589762
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2,2-dimethylpropanamide
CID 3220730
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]cyclobutanecarboxamide
CID 16589812
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-3-(4-methoxyphenyl)propanamide
CID 18149186
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]cyclohexanecarboxamide
CID 3220728
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-1-(4-chlorobenzoyl)piperidine-3-carboxamide
CID 16613398
4-amino-N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pentanamide
CID 120564436
2-(4-hydroxypiperidin-1-yl)-N-phenylacetamide
CID 39902294
2-[4-[2-(4-chloroanilino)-2-oxoethyl]piperazin-1-yl]-N-cyclopropyl-2-oxoacetamide
CID 55735068
N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-(4-hydroxyphenyl)acetamide
CID 78822391

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide?
The IUPAC name of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide (CID 16589818) is N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide.
What is the SMILES notation for N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide?
The canonical SMILES for N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide is O=C(CN1CCC(NC(=O)Cc2ccc(Cl)cc2)CC1)Nc1ccccc1.
What is the InChIKey of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide?
The InChIKey is RNEOKIPWUIFQFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClN3O2/c22-17-8-6-16(7-9-17)14-20(26)23-19-10-12-25(13-11-19)15-21(27)24-18-4-2-1-3-5-18/h1-9,19H,10-15H2,(H,23,26)(H,24,27).
What are the key properties of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide?
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide has a molecular weight of 385.89 g/mol, XLogP of 3.10, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-chlorophenyl)acetamide is sourced from PubChem (CID 16589818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).