3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide

C16H16FNO2 — CID 91686884

IUPAC3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide
SMILESNC(=O)CCc1ccc(OCc2ccc(F)cc2)cc1
InChIInChI=1S/C16H16FNO2/c17-14-6-1-13(2-7-14)11-20-15-8-3-12(4-9-15)5-10-16(18)19/h1-4,6-9H,5,10-11H2,(H2,18,19)
InChIKeyLBDDKHYYYIAXII-UHFFFAOYSA-N
MW273.31 g/mol
LogP2.82
Rot. Bonds6

About 3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide

3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide (PubChem CID 91686884) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is 3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide.

Molecular Properties

Compound Name3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide
PubChem CID91686884
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC Name3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide
SMILESNC(=O)CCc1ccc(OCc2ccc(F)cc2)cc1
InChIInChI=1S/C16H16FNO2/c17-14-6-1-13(2-7-14)11-20-15-8-3-12(4-9-15)5-10-16(18)19/h1-4,6-9H,5,10-11H2,(H2,18,19)
InChIKeyLBDDKHYYYIAXII-UHFFFAOYSA-N
XLogP2.82
TPSA52.32 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 ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[4-(4-fluorophenyl)phenyl]propanamide
CID 150390429
3-[4-[(4-phenacyloxyphenyl)methoxy]phenyl]propanamide
CID 66685338
4-(4-fluorophenoxy)butanamide
CID 43244704
2-[4-(3-amino-3-oxopropyl)phenoxy]acetic acid
CID 170185856
3-(4-ethoxyphenyl)propanamide;hydrochloride
CID 172679140
3-[4-(3-amino-3-oxopropyl)phenyl]propanamide
CID 102388205
1-fluoro-4-[[4-[[4-[(4-fluorophenoxy)methyl]phenyl]methyl]phenyl]methoxy]benzene
CID 129203352
11-(4-fluorophenyl)undecanamide
CID 144640590
3-(3,4-dichlorophenyl)-N-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]propanamide
CID 100596570
2-[4-[(4-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide
CID 24692353
2-[4-[(4-fluorophenyl)methoxy]phenyl]-2-oxoacetaldehyde
CID 13340101
N-[(4-fluorophenyl)methyl]-2-(4-phenylmethoxyphenoxy)acetamide
CID 7478807

Frequently Asked Questions

What is the IUPAC name of 3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide?
The IUPAC name of 3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide (CID 91686884) is 3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide.
What is the SMILES notation for 3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide?
The canonical SMILES for 3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide is NC(=O)CCc1ccc(OCc2ccc(F)cc2)cc1.
What is the InChIKey of 3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide?
The InChIKey is LBDDKHYYYIAXII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c17-14-6-1-13(2-7-14)11-20-15-8-3-12(4-9-15)5-10-16(18)19/h1-4,6-9H,5,10-11H2,(H2,18,19).
What are the key properties of 3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide?
3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide has a molecular weight of 273.31 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide is sourced from PubChem (CID 91686884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).