N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide

C15H17ClF2N2O2 — CID 75468522

IUPACN-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide
SMILESCN1CCC(C(=O)N(CC(F)F)c2cccc(Cl)c2)CC1=O
InChIInChI=1S/C15H17ClF2N2O2/c1-19-6-5-10(7-14(19)21)15(22)20(9-13(17)18)12-4-2-3-11(16)8-12/h2-4,8,10,13H,5-7,9H2,1H3
InChIKeyUKXBQUUMTDCEBQ-UHFFFAOYSA-N
MW330.76 g/mol
LogP2.81
Rot. Bonds4

About N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide

N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide (PubChem CID 75468522) has the molecular formula C15H17ClF2N2O2 and a molecular weight of 330.76 g/mol. Its IUPAC name is N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide
PubChem CID75468522
Molecular FormulaC15H17ClF2N2O2
Molecular Weight330.76 g/mol
Exact Mass330.09
IUPAC NameN-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide
SMILESCN1CCC(C(=O)N(CC(F)F)c2cccc(Cl)c2)CC1=O
InChIInChI=1S/C15H17ClF2N2O2/c1-19-6-5-10(7-14(19)21)15(22)20(9-13(17)18)12-4-2-3-11(16)8-12/h2-4,8,10,13H,5-7,9H2,1H3
InChIKeyUKXBQUUMTDCEBQ-UHFFFAOYSA-N
XLogP2.81
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.76
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-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

N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-7-oxabicyclo[2.2.1]heptane-2-carboxamide
CID 71858669
N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1,5-dimethylpyrazole-3-carboxamide
CID 71858665
(4S)-1-methyl-2-oxo-N-phenyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide
CID 95331565
N-(3-chlorophenyl)-1-methyl-5-oxo-N-(3-spiro[indene-1,4'-piperidine]-1'-ylpropyl)pyrrolidine-3-carboxamide;hydrochloride
CID 139916265
2-[(4-chlorophenyl)methyl-(1-methyl-2-oxopiperidine-4-carbonyl)amino]acetic acid
CID 119193545
1-acetyl-N-[3-(4-benzylpiperazin-1-yl)propyl]-N-(3-chlorophenyl)piperidine-4-carboxamide;2,2,2-trifluoroacetic acid
CID 18539187
(4R,8R)-8-[(3-chlorophenyl)methylamino]-N,N-diethyl-1-methyl-2-oxoazonane-4-carboxamide
CID 75411811
1-[3-(N-(1-acetylpiperidine-4-carbonyl)-3-chloroanilino)propyl]-N-benzylpiperidine-4-carboxamide
CID 57331274
1-acetyl-N-(3-chlorophenyl)-N-[3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]propyl]piperidine-4-carboxamide
CID 18539084
1-methyl-2-oxo-N-propan-2-yl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 75461730
2-[cyclopropyl-(1-methyl-2-oxopiperidine-4-carbonyl)amino]acetic acid
CID 119194812
1-[3-(N-(1-acetylpiperidine-4-carbonyl)-3-chloroanilino)propyl]-N-ethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
CID 57331340

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide (CID 75468522) is N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide is CN1CCC(C(=O)N(CC(F)F)c2cccc(Cl)c2)CC1=O.
What is the InChIKey of N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide?
The InChIKey is UKXBQUUMTDCEBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClF2N2O2/c1-19-6-5-10(7-14(19)21)15(22)20(9-13(17)18)12-4-2-3-11(16)8-12/h2-4,8,10,13H,5-7,9H2,1H3.
What are the key properties of N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide?
N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide has a molecular weight of 330.76 g/mol, XLogP of 2.81, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-N-(2,2-difluoroethyl)-1-methyl-2-oxopiperidine-4-carboxamide is sourced from PubChem (CID 75468522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).