N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide

C13H12FN3O — CID 118560751

IUPACN-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(-c2cncc(F)c2)cn1
InChIInChI=1S/C13H12FN3O/c1-2-13(18)17-12-4-3-9(7-16-12)10-5-11(14)8-15-6-10/h3-8H,2H2,1H3,(H,16,17,18)
InChIKeyXQIAQIIXSWRDTR-UHFFFAOYSA-N
MW245.26 g/mol
LogP2.63
Rot. Bonds3

About N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide

N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide (PubChem CID 118560751) has the molecular formula C13H12FN3O and a molecular weight of 245.26 g/mol. Its IUPAC name is N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide
PubChem CID118560751
Molecular FormulaC13H12FN3O
Molecular Weight245.26 g/mol
Exact Mass245.10
IUPAC NameN-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(-c2cncc(F)c2)cn1
InChIInChI=1S/C13H12FN3O/c1-2-13(18)17-12-4-3-9(7-16-12)10-5-11(14)8-15-6-10/h3-8H,2H2,1H3,(H,16,17,18)
InChIKeyXQIAQIIXSWRDTR-UHFFFAOYSA-N
XLogP2.63
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]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-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]-2-(6-methyl-5,7-dioxo-3,4-dihydro-2H-pyrrolo[3,4-b]pyridin-1-yl)acetamide
CID 118174168
2-(2-cyclopropyl-6-methyl-1,3-dioxoisoindol-4-yl)-N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]acetamide
CID 118560643
N-[5-(1,3-thiazol-2-yl)-2-pyridinyl]propanamide
CID 123161282
N-[5-[(4-fluorophenyl)methylamino]-2-pyridinyl]propanamide
CID 113027073
N-[5-(propylamino)-2-pyridinyl]propanamide
CID 113023412
N-[6-(4-fluoroanilino)-3-pyridinyl]propanamide
CID 113018289
N-[5-(5-ethoxypyrazin-2-yl)-2-pyridinyl]propanamide
CID 155733906
2-[2-(cyclopropylsulfonylamino)-1,3-thiazol-4-yl]-N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]-2-methylpropanamide
CID 138673909
3-[5-(3,5-difluorophenyl)-2-pyridinyl]-1-[(2S)-2-hydroxypropyl]-1-methylurea
CID 156738014
N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]-2-pyridinyl]propanamide
CID 129116524
N-[5-(4-methylanilino)-2-pyridinyl]propanamide
CID 113031521
N-[4-(5-formyl-3-pyridinyl)-2-pyridinyl]propanamide
CID 166785712

Frequently Asked Questions

What is the IUPAC name of N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide?
The IUPAC name of N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide (CID 118560751) is N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide.
What is the SMILES notation for N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide?
The canonical SMILES for N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide is CCC(=O)Nc1ccc(-c2cncc(F)c2)cn1.
What is the InChIKey of N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide?
The InChIKey is XQIAQIIXSWRDTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O/c1-2-13(18)17-12-4-3-9(7-16-12)10-5-11(14)8-15-6-10/h3-8H,2H2,1H3,(H,16,17,18).
What are the key properties of N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide?
N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide has a molecular weight of 245.26 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-fluoro-3-pyridinyl)-2-pyridinyl]propanamide is sourced from PubChem (CID 118560751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).