N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide

C16H22F2N4O2 — CID 155556675

IUPACN'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
SMILESCC1(C)CC(NC(=O)C(=O)Nc2cnc(F)c(F)c2)CC(C)(C)N1
InChIInChI=1S/C16H22F2N4O2/c1-15(2)6-10(7-16(3,4)22-15)21-14(24)13(23)20-9-5-11(17)12(18)19-8-9/h5,8,10,22H,6-7H2,1-4H3,(H,20,23)(H,21,24)
InChIKeyMQZRSIMQTSZLLU-UHFFFAOYSA-N
MW340.37 g/mol
LogP1.72
Rot. Bonds2

About N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide

N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide (PubChem CID 155556675) has the molecular formula C16H22F2N4O2 and a molecular weight of 340.37 g/mol. Its IUPAC name is N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide.

Molecular Properties

Compound NameN'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
PubChem CID155556675
Molecular FormulaC16H22F2N4O2
Molecular Weight340.37 g/mol
Exact Mass340.17
IUPAC NameN'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
SMILESCC1(C)CC(NC(=O)C(=O)Nc2cnc(F)c(F)c2)CC(C)(C)N1
InChIInChI=1S/C16H22F2N4O2/c1-15(2)6-10(7-16(3,4)22-15)21-14(24)13(23)20-9-5-11(17)12(18)19-8-9/h5,8,10,22H,6-7H2,1-4H3,(H,20,23)(H,21,24)
InChIKeyMQZRSIMQTSZLLU-UHFFFAOYSA-N
XLogP1.72
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.37
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide?
The IUPAC name of N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide (CID 155556675) is N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide.
What is the SMILES notation for N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide?
The canonical SMILES for N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide is CC1(C)CC(NC(=O)C(=O)Nc2cnc(F)c(F)c2)CC(C)(C)N1.
What is the InChIKey of N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide?
The InChIKey is MQZRSIMQTSZLLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22F2N4O2/c1-15(2)6-10(7-16(3,4)22-15)21-14(24)13(23)20-9-5-11(17)12(18)19-8-9/h5,8,10,22H,6-7H2,1-4H3,(H,20,23)(H,21,24).
What are the key properties of N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide?
N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide has a molecular weight of 340.37 g/mol, XLogP of 1.72, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5,6-difluoro-3-pyridinyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide is sourced from PubChem (CID 155556675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).