N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide

C17H16FNO3 — CID 44561095

IUPACN-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide
SMILESCC(=O)NC(CC(=O)c1ccc(F)cc1)c1ccc(O)cc1
InChIInChI=1S/C17H16FNO3/c1-11(20)19-16(12-4-8-15(21)9-5-12)10-17(22)13-2-6-14(18)7-3-13/h2-9,16,21H,10H2,1H3,(H,19,20)
InChIKeyJTHOGKBBRZJMGI-UHFFFAOYSA-N
MW301.32 g/mol
LogP2.98
Rot. Bonds5

About N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide

N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide (PubChem CID 44561095) has the molecular formula C17H16FNO3 and a molecular weight of 301.32 g/mol. Its IUPAC name is N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide.

Molecular Properties

Compound NameN-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide
PubChem CID44561095
Molecular FormulaC17H16FNO3
Molecular Weight301.32 g/mol
Exact Mass301.11
IUPAC NameN-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide
SMILESCC(=O)NC(CC(=O)c1ccc(F)cc1)c1ccc(O)cc1
InChIInChI=1S/C17H16FNO3/c1-11(20)19-16(12-4-8-15(21)9-5-12)10-17(22)13-2-6-14(18)7-3-13/h2-9,16,21H,10H2,1H3,(H,19,20)
InChIKeyJTHOGKBBRZJMGI-UHFFFAOYSA-N
XLogP2.98
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.32
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide 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

3-[1-(4-fluorophenyl)-3-(4-methylphenyl)-3-oxopropyl]-1,1-dimethylurea
CID 52952445
N-[3-[2-(4-fluorobenzoyl)hydrazinyl]-3-oxo-1-phenylpropyl]acetamide
CID 4789962
N-[(1R)-3,3-difluoro-1-(4-fluorophenyl)propyl]acetamide
CID 139050394
N-[(2S)-4-(4-fluorophenyl)-4-oxobutan-2-yl]-2-(4-hydroxyphenyl)acetamide
CID 97331214
4-acetamido-4-(4-fluorophenyl)butanoic acid
CID 110671651
benzyl N-[1-(4-fluorophenyl)-3-oxo-3-phenylpropyl]carbamate
CID 12000243
N-[1-(4-chlorophenyl)-3-[2-[2-(4-fluorophenyl)acetyl]hydrazinyl]-3-oxopropyl]acetamide
CID 51195838
3-[(4-fluorobenzoyl)amino]-3-(4-fluorophenyl)propanoic acid
CID 4558174
(3S)-1,3-bis(4-chlorophenyl)-3-(4-fluoroanilino)propan-1-one
CID 7034447
3-(4-chloroanilino)-1-(4-fluorophenyl)-3-(4-propan-2-ylphenyl)propan-1-one
CID 132593664
N'-[(1S)-3-(4-fluorophenyl)-3-oxo-1-phenylpropyl]benzohydrazide
CID 53355842
(3R)-3-(4-fluorophenyl)-3-(4-methylanilino)-1-phenylpropan-1-one
CID 766742

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide?
The IUPAC name of N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide (CID 44561095) is N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide.
What is the SMILES notation for N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide?
The canonical SMILES for N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide is CC(=O)NC(CC(=O)c1ccc(F)cc1)c1ccc(O)cc1.
What is the InChIKey of N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide?
The InChIKey is JTHOGKBBRZJMGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FNO3/c1-11(20)19-16(12-4-8-15(21)9-5-12)10-17(22)13-2-6-14(18)7-3-13/h2-9,16,21H,10H2,1H3,(H,19,20).
What are the key properties of N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide?
N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide has a molecular weight of 301.32 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-fluorophenyl)-1-(4-hydroxyphenyl)-3-oxopropyl]acetamide is sourced from PubChem (CID 44561095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).