2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide

C10H12FN3O3 — CID 115371762

IUPAC2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)Oc1ccc(F)nc1
InChIInChI=1S/C10H12FN3O3/c1-6(9(15)14-10(16)12-2)17-7-3-4-8(11)13-5-7/h3-6H,1-2H3,(H2,12,14,15,16)
InChIKeyFAKRPUVNPAWNFK-UHFFFAOYSA-N
MW241.22 g/mol
LogP0.44
Rot. Bonds3

About 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide

2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide (PubChem CID 115371762) has the molecular formula C10H12FN3O3 and a molecular weight of 241.22 g/mol. Its IUPAC name is 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide
PubChem CID115371762
Molecular FormulaC10H12FN3O3
Molecular Weight241.22 g/mol
Exact Mass241.09
IUPAC Name2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)Oc1ccc(F)nc1
InChIInChI=1S/C10H12FN3O3/c1-6(9(15)14-10(16)12-2)17-7-3-4-8(11)13-5-7/h3-6H,1-2H3,(H2,12,14,15,16)
InChIKeyFAKRPUVNPAWNFK-UHFFFAOYSA-N
XLogP0.44
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.22
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)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

2-[[6-(hydroxymethyl)-3-pyridinyl]oxy]-N-(methylcarbamoyl)propanamide
CID 79799543
2-[(6-fluoro-3-pyridinyl)oxy]-N-pentan-2-ylpropanamide
CID 113296486
2-[(6-fluoro-3-pyridinyl)oxy]-N-(2-methylbutan-2-yl)propanamide
CID 113296492
2-(4-carbamothioylphenoxy)-N-(methylcarbamoyl)propanamide
CID 43116873
2-[4-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 107709553
N-(methylcarbamoyl)-2-[4-(2-oxopropyl)phenoxy]propanamide
CID 115495453
2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide
CID 79782281
(2R)-N-(methylcarbamoyl)-2-(3-methylphenoxy)propanamide
CID 7817429
2-[4-(ethylaminomethyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 43276952
(2R)-2-[3,5-bis(trifluoromethyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 7796196
2-[[6-(hydroxymethyl)-3-pyridinyl]oxy]-N-methylpropanamide
CID 79799827
2-[(6-bromo-3-pyridinyl)oxy]-N-carbamoylpropanamide
CID 107396697

Frequently Asked Questions

What is the IUPAC name of 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide?
The IUPAC name of 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide (CID 115371762) is 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide.
What is the SMILES notation for 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide?
The canonical SMILES for 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide is CNC(=O)NC(=O)C(C)Oc1ccc(F)nc1.
What is the InChIKey of 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide?
The InChIKey is FAKRPUVNPAWNFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3O3/c1-6(9(15)14-10(16)12-2)17-7-3-4-8(11)13-5-7/h3-6H,1-2H3,(H2,12,14,15,16).
What are the key properties of 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide?
2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide has a molecular weight of 241.22 g/mol, XLogP of 0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide is sourced from PubChem (CID 115371762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).