N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide

C12H16FNO2 — CID 79199621

IUPACN-[(4-fluorophenyl)methyl]-5-hydroxypentanamide
SMILESO=C(CCCCO)NCc1ccc(F)cc1
InChIInChI=1S/C12H16FNO2/c13-11-6-4-10(5-7-11)9-14-12(16)3-1-2-8-15/h4-7,15H,1-3,8-9H2,(H,14,16)
InChIKeyYLLBIAVDRJUDAZ-UHFFFAOYSA-N
MW225.26 g/mol
LogP1.60
Rot. Bonds6

About N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide

N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide (PubChem CID 79199621) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-5-hydroxypentanamide
PubChem CID79199621
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC NameN-[(4-fluorophenyl)methyl]-5-hydroxypentanamide
SMILESO=C(CCCCO)NCc1ccc(F)cc1
InChIInChI=1S/C12H16FNO2/c13-11-6-4-10(5-7-11)9-14-12(16)3-1-2-8-15/h4-7,15H,1-3,8-9H2,(H,14,16)
InChIKeyYLLBIAVDRJUDAZ-UHFFFAOYSA-N
XLogP1.60
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide 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

18-hydroxy-N-[[4-[(18-hydroxyoctadecanoylamino)methyl]phenyl]methyl]octadecanamide
CID 101321590
5-(4-fluorophenyl)-N-[(4-fluorophenyl)methyl]pentanamide
CID 110297766
N-[(4-fluorophenyl)methyl]-8-oxooctanamide
CID 90932899
3-bromo-N-[(4-fluorophenyl)methyl]propanamide
CID 82109688
N-benzyl-N'-[(4-fluorophenyl)methyl]butanediamide
CID 91939014
N-[(4-fluorophenyl)methyl]-2-[5-hydroxypentyl(methyl)amino]acetamide
CID 107203780
N-[(4-fluorophenyl)methyl]-5-thiophen-2-ylpentanamide
CID 110297704
3-[(4-fluorophenyl)methylamino]-3-oxopropanoic acid
CID 62230048
2-chloro-N-[(4-fluorophenyl)methyl]acetamide
CID 2303709
6-[(4-fluorophenyl)methylcarbamoylamino]-6-oxohexanoic acid
CID 43447329
4-hydroxy-N-(pyridin-4-ylmethyl)butanamide
CID 79002356
6-[[4-(hydroxymethyl)phenyl]methylamino]-6-oxohexanoic acid
CID 107229596

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide (CID 79199621) is N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide is O=C(CCCCO)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide?
The InChIKey is YLLBIAVDRJUDAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO2/c13-11-6-4-10(5-7-11)9-14-12(16)3-1-2-8-15/h4-7,15H,1-3,8-9H2,(H,14,16).
What are the key properties of N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide?
N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide has a molecular weight of 225.26 g/mol, XLogP of 1.60, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide is sourced from PubChem (CID 79199621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).