6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide

C14H20FN3O2 — CID 63979339

IUPAC6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)CN(CCC)C(=O)c1ccc(F)nc1
InChIInChI=1S/C14H20FN3O2/c1-3-7-16-13(19)10-18(8-4-2)14(20)11-5-6-12(15)17-9-11/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,16,19)
InChIKeyGSCKJXHRMAYCER-UHFFFAOYSA-N
MW281.33 g/mol
LogP1.60
Rot. Bonds7

About 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide

6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide (PubChem CID 63979339) has the molecular formula C14H20FN3O2 and a molecular weight of 281.33 g/mol. Its IUPAC name is 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide
PubChem CID63979339
Molecular FormulaC14H20FN3O2
Molecular Weight281.33 g/mol
Exact Mass281.15
IUPAC Name6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)CN(CCC)C(=O)c1ccc(F)nc1
InChIInChI=1S/C14H20FN3O2/c1-3-7-16-13(19)10-18(8-4-2)14(20)11-5-6-12(15)17-9-11/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,16,19)
InChIKeyGSCKJXHRMAYCER-UHFFFAOYSA-N
XLogP1.60
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide 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

6-fluoro-N-[(4-methylphenyl)methyl]-N-propylpyridine-3-carboxamide
CID 63973383
methyl 2-[(6-fluoropyridine-3-carbonyl)-(2-methoxy-2-oxoethyl)amino]acetate
CID 63979190
5-bromo-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-2-carboxamide
CID 62955102
N-[2-[ethyl(propyl)amino]ethyl]-6-fluoropyridine-3-carboxamide
CID 103719344
6-fluoro-N-hexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 63979343
4-(1,3-dithiolan-2-yl)-N-[2-oxo-2-(propylamino)ethyl]-N-propylbenzamide
CID 87022112
4-[methoxy(methyl)sulfamoyl]-N-[2-oxo-2-(propylamino)ethyl]-N-propylbenzamide
CID 55892850
6-fluoro-N-methyl-N-[2-(methylamino)-2-oxoethyl]pyridine-3-carboxamide
CID 63971210
2-[(6-fluoro-3-pyridinyl)oxy]-N-propylacetamide
CID 115371607
N-ethyl-6-fluoro-N-methylpyridine-3-carboxamide
CID 63972560
6-[[2-oxo-2-(propylamino)ethyl]-propylcarbamoyl]pyridine-2-carboxylic acid
CID 119181957
6-bromo-N-ethyl-N-propylpyridine-3-carboxamide
CID 66463470

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide?
The IUPAC name of 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide (CID 63979339) is 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide?
The canonical SMILES for 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide is CCCNC(=O)CN(CCC)C(=O)c1ccc(F)nc1.
What is the InChIKey of 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide?
The InChIKey is GSCKJXHRMAYCER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O2/c1-3-7-16-13(19)10-18(8-4-2)14(20)11-5-6-12(15)17-9-11/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,16,19).
What are the key properties of 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide?
6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide has a molecular weight of 281.33 g/mol, XLogP of 1.60, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-[2-oxo-2-(propylamino)ethyl]-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 63979339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).