4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide

C19H18FN3O2 — CID 171133499

IUPAC4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide
SMILESO=C(CCCn1cc(Oc2ccc(F)cc2)cn1)Nc1ccccc1
InChIInChI=1S/C19H18FN3O2/c20-15-8-10-17(11-9-15)25-18-13-21-23(14-18)12-4-7-19(24)22-16-5-2-1-3-6-16/h1-3,5-6,8-11,13-14H,4,7,12H2,(H,22,24)
InChIKeyVOESWPKDYILGIF-UHFFFAOYSA-N
MW339.37 g/mol
LogP4.23
Rot. Bonds7

About 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide

4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide (PubChem CID 171133499) has the molecular formula C19H18FN3O2 and a molecular weight of 339.37 g/mol. Its IUPAC name is 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide.

Molecular Properties

Compound Name4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide
PubChem CID171133499
Molecular FormulaC19H18FN3O2
Molecular Weight339.37 g/mol
Exact Mass339.14
IUPAC Name4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide
SMILESO=C(CCCn1cc(Oc2ccc(F)cc2)cn1)Nc1ccccc1
InChIInChI=1S/C19H18FN3O2/c20-15-8-10-17(11-9-15)25-18-13-21-23(14-18)12-4-7-19(24)22-16-5-2-1-3-6-16/h1-3,5-6,8-11,13-14H,4,7,12H2,(H,22,24)
InChIKeyVOESWPKDYILGIF-UHFFFAOYSA-N
XLogP4.23
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide 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

4-(4-fluorophenoxy)-N-phenylbutanamide
CID 60723715
N-methyl-4-[[2-(4-phenoxypyrazol-1-yl)acetyl]amino]benzamide
CID 171133571
4-(4-iodopyrazol-1-yl)-N-pyridin-3-ylbutanamide
CID 126421662
N-phenyl-3-(4-pyrrol-1-ylpyrazol-1-yl)propanamide
CID 75432738
5-chloro-N-(4-phenoxyphenyl)pentanamide
CID 28971507
3-phenyl-N-[1-(2-phenylethyl)pyrazol-4-yl]propanamide
CID 95744744
[2-(4-fluoroanilino)-2-oxoethyl]-methyl-[2-oxo-2-(4-phenoxyanilino)ethyl]azanium
CID 7999133
N-[3-[(4-fluorophenyl)methoxy]phenyl]-3-(4-methylpyrazol-1-yl)propanamide
CID 87040595
N-(4-aminophenyl)-4-(4-methylpyrazol-1-yl)butanamide
CID 60871928
N-[4-(2H-tetrazol-5-yloxy)phenyl]-4-(1,2,4-triazol-1-yl)butanamide
CID 131920439
3-(4-chloropyrazol-1-yl)-N-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]propanamide
CID 19410011
4-(4-fluorophenoxy)-N-pyridin-4-ylbutanamide
CID 39953910

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide?
The IUPAC name of 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide (CID 171133499) is 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide.
What is the SMILES notation for 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide?
The canonical SMILES for 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide is O=C(CCCn1cc(Oc2ccc(F)cc2)cn1)Nc1ccccc1.
What is the InChIKey of 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide?
The InChIKey is VOESWPKDYILGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O2/c20-15-8-10-17(11-9-15)25-18-13-21-23(14-18)12-4-7-19(24)22-16-5-2-1-3-6-16/h1-3,5-6,8-11,13-14H,4,7,12H2,(H,22,24).
What are the key properties of 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide?
4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide has a molecular weight of 339.37 g/mol, XLogP of 4.23, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-fluorophenoxy)pyrazol-1-yl]-N-phenylbutanamide is sourced from PubChem (CID 171133499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).