3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide

C11H14FNO3 — CID 69414023

IUPAC3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide
SMILESCOCOC(CC(N)=O)c1ccc(F)cc1
InChIInChI=1S/C11H14FNO3/c1-15-7-16-10(6-11(13)14)8-2-4-9(12)5-3-8/h2-5,10H,6-7H2,1H3,(H2,13,14)
InChIKeyJVMGWDBCTBMWNQ-UHFFFAOYSA-N
MW227.24 g/mol
LogP1.36
Rot. Bonds6

About 3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide

3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide (PubChem CID 69414023) has the molecular formula C11H14FNO3 and a molecular weight of 227.24 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide
PubChem CID69414023
Molecular FormulaC11H14FNO3
Molecular Weight227.24 g/mol
Exact Mass227.10
IUPAC Name3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide
SMILESCOCOC(CC(N)=O)c1ccc(F)cc1
InChIInChI=1S/C11H14FNO3/c1-15-7-16-10(6-11(13)14)8-2-4-9(12)5-3-8/h2-5,10H,6-7H2,1H3,(H2,13,14)
InChIKeyJVMGWDBCTBMWNQ-UHFFFAOYSA-N
XLogP1.36
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.24
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 3-(4-fluorophenyl)-3-(methoxymethoxy)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

3-(4-fluorophenyl)-3-methoxypropanamide
CID 69418867
[1-(4-fluorophenyl)-1-(methoxymethoxy)propan-2-yl] carbamate
CID 123829559
(3S)-3-(4-fluorophenyl)-4-methoxy-4-methylpentanamide
CID 158718442
2-(4-fluorophenyl)butanediamide
CID 69053213
3-(4-fluorophenyl)-4,4-dimethylpentanamide
CID 82080473
(3R,4R)-4-(4-fluorophenyl)-4-hydroxy-3-methylbutanamide
CID 163672048
[3-carbamoyloxy-2-(4-fluorophenyl)propyl] carbamate
CID 10332621
methyl 2-(4-fluorophenyl)-3-methoxypropanoate
CID 117245338
3-(4-fluorophenyl)-3-(propylamino)propanamide
CID 65235429
dimethyl (2R)-2-(4-fluorophenyl)butanedioate
CID 94675067
3-amino-3-(3-fluoro-4-methoxyphenyl)propanamide
CID 65096717
ethyl 3,3-bis(4-fluorophenyl)propanoate
CID 23522917

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide?
The IUPAC name of 3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide (CID 69414023) is 3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide.
What is the SMILES notation for 3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide?
The canonical SMILES for 3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide is COCOC(CC(N)=O)c1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide?
The InChIKey is JVMGWDBCTBMWNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO3/c1-15-7-16-10(6-11(13)14)8-2-4-9(12)5-3-8/h2-5,10H,6-7H2,1H3,(H2,13,14).
What are the key properties of 3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide?
3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide has a molecular weight of 227.24 g/mol, XLogP of 1.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-3-(methoxymethoxy)propanamide is sourced from PubChem (CID 69414023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).