N-(2-fluorophenyl)hexanamide

C12H16FNO — CID 3481165

IUPACN-(2-fluorophenyl)hexanamide
SMILESCCCCCC(=O)Nc1ccccc1F
InChIInChI=1S/C12H16FNO/c1-2-3-4-9-12(15)14-11-8-6-5-7-10(11)13/h5-8H,2-4,9H2,1H3,(H,14,15)
InChIKeyVNJUVNHCSHDQGT-UHFFFAOYSA-N
MW209.26 g/mol
LogP3.34
Rot. Bonds5

About N-(2-fluorophenyl)hexanamide

N-(2-fluorophenyl)hexanamide (PubChem CID 3481165) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is N-(2-fluorophenyl)hexanamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)hexanamide
PubChem CID3481165
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC NameN-(2-fluorophenyl)hexanamide
SMILESCCCCCC(=O)Nc1ccccc1F
InChIInChI=1S/C12H16FNO/c1-2-3-4-9-12(15)14-11-8-6-5-7-10(11)13/h5-8H,2-4,9H2,1H3,(H,14,15)
InChIKeyVNJUVNHCSHDQGT-UHFFFAOYSA-N
XLogP3.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 53.34
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-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide
CID 42765956
N-(2-fluorophenyl)butanamide
CID 849021
N-(2-fluorophenyl)-5-hydroxypentanamide
CID 79019059
N-[2-(2-fluoroanilino)-2-oxoethyl]pentanamide
CID 42765949
N-[3-[[2-(2-fluoroanilino)-2-oxoethyl]amino]phenyl]hexanamide
CID 54842530
N-(2-aminophenyl)octadecanamide
CID 68839220
N-(2,4-difluorophenyl)hexanamide
CID 3484261
N-(2-fluorophenyl)-2-(octylamino)acetamide
CID 78914339
N-(2-ethylphenyl)heptanamide
CID 4582103
N-(2-chlorophenyl)hexanamide
CID 4644560
N-(2-ethylphenyl)undecanamide
CID 5078439
3-[butyl(methylsulfonyl)amino]-N-(2-fluorophenyl)propanamide
CID 113136736

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)hexanamide?
The IUPAC name of N-(2-fluorophenyl)hexanamide (CID 3481165) is N-(2-fluorophenyl)hexanamide.
What is the SMILES notation for N-(2-fluorophenyl)hexanamide?
The canonical SMILES for N-(2-fluorophenyl)hexanamide is CCCCCC(=O)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)hexanamide?
The InChIKey is VNJUVNHCSHDQGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c1-2-3-4-9-12(15)14-11-8-6-5-7-10(11)13/h5-8H,2-4,9H2,1H3,(H,14,15).
What are the key properties of N-(2-fluorophenyl)hexanamide?
N-(2-fluorophenyl)hexanamide has a molecular weight of 209.26 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)hexanamide is sourced from PubChem (CID 3481165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).