N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide

C17H19F3N2O3 — CID 52944607

IUPACN-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide
SMILESO=C(CCC1=CCCN(CCc2cccc(C(F)(F)F)c2)C1=O)NO
InChIInChI=1S/C17H19F3N2O3/c18-17(19,20)14-5-1-3-12(11-14)8-10-22-9-2-4-13(16(22)24)6-7-15(23)21-25/h1,3-5,11,25H,2,6-10H2,(H,21,23)
InChIKeySENBZOCNICIWQK-UHFFFAOYSA-N
MW356.34 g/mol
LogP2.69
Rot. Bonds6

About N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide

N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide (PubChem CID 52944607) has the molecular formula C17H19F3N2O3 and a molecular weight of 356.34 g/mol. Its IUPAC name is N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide.

Molecular Properties

Compound NameN-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide
PubChem CID52944607
Molecular FormulaC17H19F3N2O3
Molecular Weight356.34 g/mol
Exact Mass356.13
IUPAC NameN-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide
SMILESO=C(CCC1=CCCN(CCc2cccc(C(F)(F)F)c2)C1=O)NO
InChIInChI=1S/C17H19F3N2O3/c18-17(19,20)14-5-1-3-12(11-14)8-10-22-9-2-4-13(16(22)24)6-7-15(23)21-25/h1,3-5,11,25H,2,6-10H2,(H,21,23)
InChIKeySENBZOCNICIWQK-UHFFFAOYSA-N
XLogP2.69
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.34
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]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

3-N-hydroxy-1-N-(2-phenylethyl)benzene-1,3-dicarboxamide
CID 71680913
6-(3,3-diphenylprop-2-enoylamino)-N-hydroxyhexanamide
CID 9903149
N-hydroxy-3-[5-oxo-1-(3-phenylpropyl)-2H-pyrrol-4-yl]propanamide
CID 9947876
3-[1-[2-(3-fluorophenyl)ethyl]-5-oxo-2H-pyrrol-4-yl]-N-hydroxypropanamide
CID 11150492
N-hydroxy-3-[1-(2-naphthalen-1-ylethyl)-5-oxo-2H-pyrrol-4-yl]propanamide
CID 11151483
N-hydroxy-3-[6-oxo-1-(4-phenylbutyl)-2,3-dihydropyridin-5-yl]propanamide
CID 11162880
N-hydroxy-3-[1-[2-(4-methylphenyl)ethyl]-5-oxo-2H-pyrrol-4-yl]propanamide
CID 11185330
N-hydroxy-3-[1-[(3-methylphenyl)methyl]-5-oxo-2H-pyrrol-4-yl]propanamide
CID 11231147
N-hydroxy-3-(1-(3-(naphthalen-2-yl)propyl)-2-oxo-2,5-dihydro-1H-pyrrol-3-yl)propanamide
CID 11244651
3-(1-benzyl-6-oxo-2,3-dihydropyridin-5-yl)-N-hydroxypropanamide
CID 11277337
N-hydroxy-3-[5-oxo-1-[3-(4-propan-2-ylphenyl)propyl]-2H-pyrrol-4-yl]propanamide
CID 11290441
3-(1-benzyl-5-oxo-2H-pyrrol-4-yl)-N-hydroxypropanamide
CID 11334453

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide?
The IUPAC name of N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide (CID 52944607) is N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide.
What is the SMILES notation for N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide?
The canonical SMILES for N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide is O=C(CCC1=CCCN(CCc2cccc(C(F)(F)F)c2)C1=O)NO.
What is the InChIKey of N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide?
The InChIKey is SENBZOCNICIWQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F3N2O3/c18-17(19,20)14-5-1-3-12(11-14)8-10-22-9-2-4-13(16(22)24)6-7-15(23)21-25/h1,3-5,11,25H,2,6-10H2,(H,21,23).
What are the key properties of N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide?
N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide has a molecular weight of 356.34 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-3-[6-oxo-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-2,3-dihydropyridin-5-yl]propanamide is sourced from PubChem (CID 52944607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).