3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide

C24H22FN3O3 — CID 55767382

IUPAC3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide
SMILESO=C(CCc1ccc(-c2ccccc2F)o1)Nc1cccc(OCCn2cccn2)c1
InChIInChI=1S/C24H22FN3O3/c25-22-8-2-1-7-21(22)23-11-9-19(31-23)10-12-24(29)27-18-5-3-6-20(17-18)30-16-15-28-14-4-13-26-28/h1-9,11,13-14,17H,10,12,15-16H2,(H,27,29)
InChIKeyIKSNYGCRHIOKCJ-UHFFFAOYSA-N
MW419.46 g/mol
LogP4.93
Rot. Bonds9

About 3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide

3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide (PubChem CID 55767382) has the molecular formula C24H22FN3O3 and a molecular weight of 419.46 g/mol. Its IUPAC name is 3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide.

Molecular Properties

Compound Name3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide
PubChem CID55767382
Molecular FormulaC24H22FN3O3
Molecular Weight419.46 g/mol
Exact Mass419.16
IUPAC Name3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide
SMILESO=C(CCc1ccc(-c2ccccc2F)o1)Nc1cccc(OCCn2cccn2)c1
InChIInChI=1S/C24H22FN3O3/c25-22-8-2-1-7-21(22)23-11-9-19(31-23)10-12-24(29)27-18-5-3-6-20(17-18)30-16-15-28-14-4-13-26-28/h1-9,11,13-14,17H,10,12,15-16H2,(H,27,29)
InChIKeyIKSNYGCRHIOKCJ-UHFFFAOYSA-N
XLogP4.93
TPSA69.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.46
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(5-phenylfuran-2-yl)-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide
CID 55767669
3-[5-(2-chlorophenyl)-1,3-oxazol-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide
CID 55854482
3-[5-(2-fluorophenyl)furan-2-yl]-N-(3-nitrophenyl)propanamide
CID 18093403
3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide
CID 32934045
4-fluoro-N-[2-oxo-2-[3-(2-pyrazol-1-ylethoxy)anilino]ethyl]benzamide
CID 55766765
4-[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]benzamide
CID 17430904
2-[2-(2-fluoroanilino)-2-oxoethoxy]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide
CID 55880459
N-(2-amino-2-oxoethyl)-3-[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]benzamide
CID 46442616
3-[5-(2-fluorophenyl)furan-2-yl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide
CID 24505736
3-cyclopentylsulfonyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide
CID 55854748
3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]propanamide
CID 24505922
4-phenyl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzamide
CID 55767479

Frequently Asked Questions

What is the IUPAC name of 3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide?
The IUPAC name of 3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide (CID 55767382) is 3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide.
What is the SMILES notation for 3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide?
The canonical SMILES for 3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide is O=C(CCc1ccc(-c2ccccc2F)o1)Nc1cccc(OCCn2cccn2)c1.
What is the InChIKey of 3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide?
The InChIKey is IKSNYGCRHIOKCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22FN3O3/c25-22-8-2-1-7-21(22)23-11-9-19(31-23)10-12-24(29)27-18-5-3-6-20(17-18)30-16-15-28-14-4-13-26-28/h1-9,11,13-14,17H,10,12,15-16H2,(H,27,29).
What are the key properties of 3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide?
3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide has a molecular weight of 419.46 g/mol, XLogP of 4.93, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(2-fluorophenyl)furan-2-yl]-N-[3-(2-pyrazol-1-ylethoxy)phenyl]propanamide is sourced from PubChem (CID 55767382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).