4-(4-fluorophenoxy)butanamide

C10H12FNO2 — CID 43244704

IUPAC4-(4-fluorophenoxy)butanamide
SMILESNC(=O)CCCOc1ccc(F)cc1
InChIInChI=1S/C10H12FNO2/c11-8-3-5-9(6-4-8)14-7-1-2-10(12)13/h3-6H,1-2,7H2,(H2,12,13)
InChIKeyXTZDDXIQIAMJCO-UHFFFAOYSA-N
MW197.21 g/mol
LogP1.47
Rot. Bonds5

About 4-(4-fluorophenoxy)butanamide

4-(4-fluorophenoxy)butanamide (PubChem CID 43244704) has the molecular formula C10H12FNO2 and a molecular weight of 197.21 g/mol. Its IUPAC name is 4-(4-fluorophenoxy)butanamide.

Molecular Properties

Compound Name4-(4-fluorophenoxy)butanamide
PubChem CID43244704
Molecular FormulaC10H12FNO2
Molecular Weight197.21 g/mol
Exact Mass197.09
IUPAC Name4-(4-fluorophenoxy)butanamide
SMILESNC(=O)CCCOc1ccc(F)cc1
InChIInChI=1S/C10H12FNO2/c11-8-3-5-9(6-4-8)14-7-1-2-10(12)13/h3-6H,1-2,7H2,(H2,12,13)
InChIKeyXTZDDXIQIAMJCO-UHFFFAOYSA-N
XLogP1.47
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 51.47
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

N-(2-amino-2-oxoethyl)-4-(4-fluorophenoxy)butanamide
CID 60724760
3-(4-fluorophenoxy)propyl carbamate
CID 154235028
4-(4-fluorophenoxy)butanethioamide
CID 24702572
5-(4-fluorophenoxy)-2-oxopentanoic acid
CID 57302572
6-(4-fluorophenoxy)hexan-2-one
CID 43793627
4-(4-tert-butylphenoxy)butanamide
CID 82041345
9-(4-fluorophenoxy)nonanoic acid
CID 66875133
methyl 2-[4-(4-fluorophenoxy)butanoylamino]propanoate
CID 60724668
3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide
CID 91686884
ethyl (2E)-5-(4-fluorophenoxy)-2-hydroxyiminopentanoate
CID 18370808
4-(4-fluorophenoxy)-N-phenylbutanamide
CID 60723715
N-(1-aminopropan-2-yl)-4-(4-fluorophenoxy)-N-methylbutanamide
CID 119582440

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenoxy)butanamide?
The IUPAC name of 4-(4-fluorophenoxy)butanamide (CID 43244704) is 4-(4-fluorophenoxy)butanamide.
What is the SMILES notation for 4-(4-fluorophenoxy)butanamide?
The canonical SMILES for 4-(4-fluorophenoxy)butanamide is NC(=O)CCCOc1ccc(F)cc1.
What is the InChIKey of 4-(4-fluorophenoxy)butanamide?
The InChIKey is XTZDDXIQIAMJCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO2/c11-8-3-5-9(6-4-8)14-7-1-2-10(12)13/h3-6H,1-2,7H2,(H2,12,13).
What are the key properties of 4-(4-fluorophenoxy)butanamide?
4-(4-fluorophenoxy)butanamide has a molecular weight of 197.21 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenoxy)butanamide is sourced from PubChem (CID 43244704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).