2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide

C17H23Cl2N3O2 — CID 108522597

IUPAC2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide
SMILESCC1(C)CC(N)CC(C)(C)N1C(=O)C(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C17H23Cl2N3O2/c1-16(2)8-10(20)9-17(3,4)22(16)15(24)14(23)21-13-11(18)6-5-7-12(13)19/h5-7,10H,8-9,20H2,1-4H3,(H,21,23)
InChIKeyUXYSAKWQIFBBKU-UHFFFAOYSA-N
MW372.30 g/mol
LogP3.44
Rot. Bonds1

About 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide

2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide (PubChem CID 108522597) has the molecular formula C17H23Cl2N3O2 and a molecular weight of 372.30 g/mol. Its IUPAC name is 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide.

Molecular Properties

Compound Name2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide
PubChem CID108522597
Molecular FormulaC17H23Cl2N3O2
Molecular Weight372.30 g/mol
Exact Mass371.12
IUPAC Name2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide
SMILESCC1(C)CC(N)CC(C)(C)N1C(=O)C(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C17H23Cl2N3O2/c1-16(2)8-10(20)9-17(3,4)22(16)15(24)14(23)21-13-11(18)6-5-7-12(13)19/h5-7,10H,8-9,20H2,1-4H3,(H,21,23)
InChIKeyUXYSAKWQIFBBKU-UHFFFAOYSA-N
XLogP3.44
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.30
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide?
The IUPAC name of 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide (CID 108522597) is 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide.
What is the SMILES notation for 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide?
The canonical SMILES for 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide is CC1(C)CC(N)CC(C)(C)N1C(=O)C(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide?
The InChIKey is UXYSAKWQIFBBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23Cl2N3O2/c1-16(2)8-10(20)9-17(3,4)22(16)15(24)14(23)21-13-11(18)6-5-7-12(13)19/h5-7,10H,8-9,20H2,1-4H3,(H,21,23).
What are the key properties of 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide?
2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide has a molecular weight of 372.30 g/mol, XLogP of 3.44, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(2,6-dichlorophenyl)-2-oxoacetamide is sourced from PubChem (CID 108522597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).