N-[3-(4-fluorophenyl)propyl]acetamide

C11H14FNO — CID 58997658

IUPACN-[3-(4-fluorophenyl)propyl]acetamide
SMILESCC(=O)NCCCc1ccc(F)cc1
InChIInChI=1S/C11H14FNO/c1-9(14)13-8-2-3-10-4-6-11(12)7-5-10/h4-7H,2-3,8H2,1H3,(H,13,14)
InChIKeyVIPHDKAJRACYMV-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.89
Rot. Bonds4

About N-[3-(4-fluorophenyl)propyl]acetamide

N-[3-(4-fluorophenyl)propyl]acetamide (PubChem CID 58997658) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is N-[3-(4-fluorophenyl)propyl]acetamide.

Molecular Properties

Compound NameN-[3-(4-fluorophenyl)propyl]acetamide
PubChem CID58997658
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC NameN-[3-(4-fluorophenyl)propyl]acetamide
SMILESCC(=O)NCCCc1ccc(F)cc1
InChIInChI=1S/C11H14FNO/c1-9(14)13-8-2-3-10-4-6-11(12)7-5-10/h4-7H,2-3,8H2,1H3,(H,13,14)
InChIKeyVIPHDKAJRACYMV-UHFFFAOYSA-N
XLogP1.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(4-acetamidobutyl)-4-(4-fluorophenyl)butanamide
CID 110355184
N-[3-(4-fluorophenyl)propyl]-2-(4-methylphenyl)acetamide
CID 92684324
2-(4-fluorophenyl)-N-[3-(4-methylphenyl)propyl]acetamide
CID 100706292
2-(4-fluorophenyl)-N-[4-(4-fluorophenyl)butyl]acetamide
CID 110288734
N-[3-(4-nitrophenyl)propyl]acetamide
CID 58774168
2-(4-fluorophenoxy)-N-[3-(4-propan-2-yloxyphenyl)propyl]propanamide
CID 132654154
N-[1-[3-(4-fluorophenyl)propylamino]-1-oxopropan-2-yl]carbamate
CID 23047132
N-[3-(4-fluorophenyl)propyl]-3,4-dimethylbenzamide
CID 100670175
N-[3-(4-fluorophenyl)propyl]-2,4-dimethylbenzamide
CID 100720245
N-[4-[2-(4-fluorophenyl)ethylamino]phenyl]acetamide
CID 112983436
[2-[4-(3-acetamidopropyl)phenyl]-2-oxoethyl] 3-fluorobenzoate
CID 7874655
N-ethyl-3-(4-fluorophenyl)propan-1-amine
CID 58997646

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-fluorophenyl)propyl]acetamide?
The IUPAC name of N-[3-(4-fluorophenyl)propyl]acetamide (CID 58997658) is N-[3-(4-fluorophenyl)propyl]acetamide.
What is the SMILES notation for N-[3-(4-fluorophenyl)propyl]acetamide?
The canonical SMILES for N-[3-(4-fluorophenyl)propyl]acetamide is CC(=O)NCCCc1ccc(F)cc1.
What is the InChIKey of N-[3-(4-fluorophenyl)propyl]acetamide?
The InChIKey is VIPHDKAJRACYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-9(14)13-8-2-3-10-4-6-11(12)7-5-10/h4-7H,2-3,8H2,1H3,(H,13,14).
What are the key properties of N-[3-(4-fluorophenyl)propyl]acetamide?
N-[3-(4-fluorophenyl)propyl]acetamide has a molecular weight of 195.24 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-fluorophenyl)propyl]acetamide is sourced from PubChem (CID 58997658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).