N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide

C14H13FN2O — CID 104820903

IUPACN-(6-fluoro-2-pyridinyl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1cccc(F)n1
InChIInChI=1S/C14H13FN2O/c15-12-7-4-8-13(16-12)17-14(18)10-9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,16,17,18)
InChIKeyZVASHWAJAWCIED-UHFFFAOYSA-N
MW244.27 g/mol
LogP2.79
Rot. Bonds4

About N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide

N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide (PubChem CID 104820903) has the molecular formula C14H13FN2O and a molecular weight of 244.27 g/mol. Its IUPAC name is N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-(6-fluoro-2-pyridinyl)-3-phenylpropanamide
PubChem CID104820903
Molecular FormulaC14H13FN2O
Molecular Weight244.27 g/mol
Exact Mass244.10
IUPAC NameN-(6-fluoro-2-pyridinyl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1cccc(F)n1
InChIInChI=1S/C14H13FN2O/c15-12-7-4-8-13(16-12)17-14(18)10-9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,16,17,18)
InChIKeyZVASHWAJAWCIED-UHFFFAOYSA-N
XLogP2.79
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(6-fluoro-2-pyridinyl)-3-(2-methylphenyl)propanamide
CID 113456887
N-(6-fluoro-2-pyridinyl)pentanamide
CID 104820722
2-(3-fluorophenyl)-N-(6-fluoro-2-pyridinyl)acetamide
CID 104820790
N-[6-(5-formylthiophen-2-yl)-2-pyridinyl]-3-phenylpropanamide
CID 142857991
3-phenyl-N-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]propanamide
CID 130474104
N-[6-(2,6-difluoroanilino)pyridazin-3-yl]-3-phenylpropanamide
CID 113051558
N-(6-fluoro-2-pyridinyl)-2-(4-methylphenyl)acetamide
CID 113456880
N-(6-fluoro-2-pyridinyl)-3,3-dimethylbutanamide
CID 104820780
N-(6-chloropyrazin-2-yl)-3-phenylpropanamide
CID 115599331
N-(6-fluoro-2-pyridinyl)-4-(propan-2-ylamino)butanamide
CID 116813202
3-phenyl-N-[5-(3-phenylpropanoylamino)naphthalen-1-yl]propanamide
CID 1010239
N-(6-fluoro-2-pyridinyl)-2-methylpropanamide
CID 104820526

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide?
The IUPAC name of N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide (CID 104820903) is N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide.
What is the SMILES notation for N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide?
The canonical SMILES for N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide is O=C(CCc1ccccc1)Nc1cccc(F)n1.
What is the InChIKey of N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide?
The InChIKey is ZVASHWAJAWCIED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O/c15-12-7-4-8-13(16-12)17-14(18)10-9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,16,17,18).
What are the key properties of N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide?
N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide has a molecular weight of 244.27 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide is sourced from PubChem (CID 104820903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).