4-(4-fluorophenoxy)-N-phenylbutanamide

C16H16FNO2 — CID 60723715

IUPAC4-(4-fluorophenoxy)-N-phenylbutanamide
SMILESO=C(CCCOc1ccc(F)cc1)Nc1ccccc1
InChIInChI=1S/C16H16FNO2/c17-13-8-10-15(11-9-13)20-12-4-7-16(19)18-14-5-2-1-3-6-14/h1-3,5-6,8-11H,4,7,12H2,(H,18,19)
InChIKeySYXBLBYMCGCTOX-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.62
Rot. Bonds6

About 4-(4-fluorophenoxy)-N-phenylbutanamide

4-(4-fluorophenoxy)-N-phenylbutanamide (PubChem CID 60723715) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is 4-(4-fluorophenoxy)-N-phenylbutanamide.

Molecular Properties

Compound Name4-(4-fluorophenoxy)-N-phenylbutanamide
PubChem CID60723715
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC Name4-(4-fluorophenoxy)-N-phenylbutanamide
SMILESO=C(CCCOc1ccc(F)cc1)Nc1ccccc1
InChIInChI=1S/C16H16FNO2/c17-13-8-10-15(11-9-13)20-12-4-7-16(19)18-14-5-2-1-3-6-14/h1-3,5-6,8-11H,4,7,12H2,(H,18,19)
InChIKeySYXBLBYMCGCTOX-UHFFFAOYSA-N
XLogP3.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(4-fluorophenoxy)-N-pyridin-4-ylbutanamide
CID 39953910
N-[4-(difluoromethoxy)phenyl]-4-phenoxybutanamide
CID 112793225
4-(4-fluorophenoxy)-N-(2-methylphenyl)butanamide
CID 86919949
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-4-(4-fluorophenoxy)butanamide
CID 32945767
N,N'-bis[4-(2-phenylethoxy)phenyl]nonanediamide
CID 17067257
5-oxo-5-[4-(2-phenoxyethoxy)anilino]pentanoic acid
CID 4958221
3-(4-fluorophenoxy)-N-(4-methylphenyl)propanamide
CID 31855578
4-(4-fluorophenoxy)-N-(4-hydroxynaphthalen-1-yl)butanamide
CID 25468956
4-(3-anilino-3-oxopropoxy)benzoic acid
CID 43243922
N-(4-fluorophenyl)-2-(3-phenoxypropylsulfanyl)acetamide
CID 7731614
3-phenyl-N-[4-(2-phenylethoxy)phenyl]propanamide
CID 17066904
4-(3-methylphenoxy)-N-phenylbutanamide
CID 19173641

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenoxy)-N-phenylbutanamide?
The IUPAC name of 4-(4-fluorophenoxy)-N-phenylbutanamide (CID 60723715) is 4-(4-fluorophenoxy)-N-phenylbutanamide.
What is the SMILES notation for 4-(4-fluorophenoxy)-N-phenylbutanamide?
The canonical SMILES for 4-(4-fluorophenoxy)-N-phenylbutanamide is O=C(CCCOc1ccc(F)cc1)Nc1ccccc1.
What is the InChIKey of 4-(4-fluorophenoxy)-N-phenylbutanamide?
The InChIKey is SYXBLBYMCGCTOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c17-13-8-10-15(11-9-13)20-12-4-7-16(19)18-14-5-2-1-3-6-14/h1-3,5-6,8-11H,4,7,12H2,(H,18,19).
What are the key properties of 4-(4-fluorophenoxy)-N-phenylbutanamide?
4-(4-fluorophenoxy)-N-phenylbutanamide has a molecular weight of 273.31 g/mol, XLogP of 3.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenoxy)-N-phenylbutanamide is sourced from PubChem (CID 60723715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).