N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide

C10H7ClF6N2O — CID 106741523

IUPACN-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
SMILESCc1cc(NC(=O)C(C(F)(F)F)C(F)(F)F)cnc1Cl
InChIInChI=1S/C10H7ClF6N2O/c1-4-2-5(3-18-7(4)11)19-8(20)6(9(12,13)14)10(15,16)17/h2-3,6H,1H3,(H,19,20)
InChIKeyUQLDPACQAIEDJX-UHFFFAOYSA-N
MW320.62 g/mol
LogP3.72
Rot. Bonds2

About N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide

N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide (PubChem CID 106741523) has the molecular formula C10H7ClF6N2O and a molecular weight of 320.62 g/mol. Its IUPAC name is N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide.

Molecular Properties

Compound NameN-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
PubChem CID106741523
Molecular FormulaC10H7ClF6N2O
Molecular Weight320.62 g/mol
Exact Mass320.02
IUPAC NameN-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
SMILESCc1cc(NC(=O)C(C(F)(F)F)C(F)(F)F)cnc1Cl
InChIInChI=1S/C10H7ClF6N2O/c1-4-2-5(3-18-7(4)11)19-8(20)6(9(12,13)14)10(15,16)17/h2-3,6H,1H3,(H,19,20)
InChIKeyUQLDPACQAIEDJX-UHFFFAOYSA-N
XLogP3.72
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.62
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide 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-(6-chloro-5-methyl-3-pyridinyl)-2-methylbutanamide
CID 103730347
N-(6-chloro-5-methyl-3-pyridinyl)-2-methyl-3-(methylamino)propanamide
CID 103811557
N-(6-chloro-5-methyl-3-pyridinyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 103745352
N-(6-chloro-5-methyl-3-pyridinyl)-3,3-dimethylbutanamide
CID 103730445
4-amino-N-(6-chloro-5-methyl-3-pyridinyl)-4-methylpentanamide
CID 103811545
N-(6-chloro-5-methyl-3-pyridinyl)-2-pyrazol-1-ylpropanamide
CID 113250420
2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-2-thiophen-2-ylacetamide
CID 114049418
(2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide
CID 103797011
N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide
CID 103730413
5-chloro-N-(6-chloro-5-methyl-3-pyridinyl)-2-methylbenzamide
CID 103842318
N-(6-chloro-5-methyl-3-pyridinyl)cyclobutanecarboxamide
CID 103730424
N-(5-amino-3-methyl-2-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 103309083

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide?
The IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide (CID 106741523) is N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide.
What is the SMILES notation for N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide?
The canonical SMILES for N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide is Cc1cc(NC(=O)C(C(F)(F)F)C(F)(F)F)cnc1Cl.
What is the InChIKey of N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide?
The InChIKey is UQLDPACQAIEDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClF6N2O/c1-4-2-5(3-18-7(4)11)19-8(20)6(9(12,13)14)10(15,16)17/h2-3,6H,1H3,(H,19,20).
What are the key properties of N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide?
N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide has a molecular weight of 320.62 g/mol, XLogP of 3.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-5-methyl-3-pyridinyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide is sourced from PubChem (CID 106741523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).