N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide

C18H25ClN2O2 — CID 86574555

IUPACN-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCc1cc(NC(=O)C(=O)C2CC(C)(C)NC(C)(C)C2)ccc1Cl
InChIInChI=1S/C18H25ClN2O2/c1-11-8-13(6-7-14(11)19)20-16(23)15(22)12-9-17(2,3)21-18(4,5)10-12/h6-8,12,21H,9-10H2,1-5H3,(H,20,23)
InChIKeyJOCWOILXWOTJER-UHFFFAOYSA-N
MW336.86 g/mol
LogP3.71
Rot. Bonds3

About N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide

N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide (PubChem CID 86574555) has the molecular formula C18H25ClN2O2 and a molecular weight of 336.86 g/mol. Its IUPAC name is N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
PubChem CID86574555
Molecular FormulaC18H25ClN2O2
Molecular Weight336.86 g/mol
Exact Mass336.16
IUPAC NameN-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCc1cc(NC(=O)C(=O)C2CC(C)(C)NC(C)(C)C2)ccc1Cl
InChIInChI=1S/C18H25ClN2O2/c1-11-8-13(6-7-14(11)19)20-16(23)15(22)12-9-17(2,3)21-18(4,5)10-12/h6-8,12,21H,9-10H2,1-5H3,(H,20,23)
InChIKeyJOCWOILXWOTJER-UHFFFAOYSA-N
XLogP3.71
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.86
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-bromo-4-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 86574257
N'-(4-chloro-3-hydroxyphenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 71590634
N'-(4-chloro-3-propan-2-yloxyphenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 53326853
ethyl 2-(4-chloro-3-methylanilino)-2-oxoacetate
CID 121223568
methyl N-(4-chloro-3-methylphenyl)carbamate
CID 67274830
(2R)-2-(4-chloro-3-methylphenoxy)-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide
CID 7380284
1-amino-3-(4-chloro-3-methylphenyl)-1-methylurea
CID 178164527
3-bromo-N-(4-chloro-3-methylphenyl)propanamide
CID 82110631
(4-chloro-3-methylphenyl)thiourea
CID 88635123
N-(3-chloro-4-methylphenyl)-3-methylpyrrolidine-3-carboxamide
CID 63140585
N-(4-chloro-3-methylphenyl)-2-piperazin-1-ylacetamide
CID 45032288
N,N'-bis(3,4-dimethylphenyl)oxamide
CID 3278038

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The IUPAC name of N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide (CID 86574555) is N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The canonical SMILES for N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide is Cc1cc(NC(=O)C(=O)C2CC(C)(C)NC(C)(C)C2)ccc1Cl.
What is the InChIKey of N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The InChIKey is JOCWOILXWOTJER-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25ClN2O2/c1-11-8-13(6-7-14(11)19)20-16(23)15(22)12-9-17(2,3)21-18(4,5)10-12/h6-8,12,21H,9-10H2,1-5H3,(H,20,23).
What are the key properties of N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide has a molecular weight of 336.86 g/mol, XLogP of 3.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-methylphenyl)-2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 86574555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).