N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide

C13H14Cl2N2O2 — CID 2194372

IUPACN-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)C(=O)N1CCCCC1
InChIInChI=1S/C13H14Cl2N2O2/c14-9-4-5-11(10(15)8-9)16-12(18)13(19)17-6-2-1-3-7-17/h4-5,8H,1-3,6-7H2,(H,16,18)
InChIKeyJMVORJYMVXTRIF-UHFFFAOYSA-N
MW301.17 g/mol
LogP2.94
Rot. Bonds1

About N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide

N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide (PubChem CID 2194372) has the molecular formula C13H14Cl2N2O2 and a molecular weight of 301.17 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide
PubChem CID2194372
Molecular FormulaC13H14Cl2N2O2
Molecular Weight301.17 g/mol
Exact Mass300.04
IUPAC NameN-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)C(=O)N1CCCCC1
InChIInChI=1S/C13H14Cl2N2O2/c14-9-4-5-11(10(15)8-9)16-12(18)13(19)17-6-2-1-3-7-17/h4-5,8H,1-3,6-7H2,(H,16,18)
InChIKeyJMVORJYMVXTRIF-UHFFFAOYSA-N
XLogP2.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.17
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2,4-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)-2-oxoacetamide
CID 108502879
ethyl 4-[2-(2,4-dichloroanilino)-2-oxoacetyl]piperazine-1-carboxylate
CID 108502954
N-(2,4-dichlorophenyl)-2,2-dimethyl-3-oxo-3-piperidin-1-ylpropanamide
CID 108958896
2-(azepan-1-yl)-N-(3-chlorophenyl)-2-oxoacetamide
CID 47335488
(3R)-1-[(2,4-dichlorophenyl)carbamoyl]piperidine-3-carboxylic acid
CID 81120293
2-(azepan-1-yl)-N-(3-chloro-2-methylphenyl)-2-oxoacetamide
CID 47335495
N-(2,4-dichlorophenyl)-1-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 108971732
N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
CID 47109120
N-[3-chloro-4-[(2-piperidin-1-yl-2-sulfanylideneacetyl)amino]phenyl]-2-piperidin-1-yl-2-sulfanylideneacetamide
CID 17384563
N-(2,6-dichlorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
CID 3450597
N-(3,5-dichlorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
CID 47335591
N-(2,4-dichlorophenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102982

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide?
The IUPAC name of N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide (CID 2194372) is N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide is O=C(Nc1ccc(Cl)cc1Cl)C(=O)N1CCCCC1.
What is the InChIKey of N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide?
The InChIKey is JMVORJYMVXTRIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Cl2N2O2/c14-9-4-5-11(10(15)8-9)16-12(18)13(19)17-6-2-1-3-7-17/h4-5,8H,1-3,6-7H2,(H,16,18).
What are the key properties of N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide?
N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide has a molecular weight of 301.17 g/mol, XLogP of 2.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide is sourced from PubChem (CID 2194372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).