3-fluoro-N-(4-propylphenyl)benzamide

C16H16FNO — CID 26178121

IUPAC3-fluoro-N-(4-propylphenyl)benzamide
SMILESCCCc1ccc(NC(=O)c2cccc(F)c2)cc1
InChIInChI=1S/C16H16FNO/c1-2-4-12-7-9-15(10-8-12)18-16(19)13-5-3-6-14(17)11-13/h3,5-11H,2,4H2,1H3,(H,18,19)
InChIKeyDUBUNWKXQWWIEC-UHFFFAOYSA-N
MW257.31 g/mol
LogP4.03
Rot. Bonds4

About 3-fluoro-N-(4-propylphenyl)benzamide

3-fluoro-N-(4-propylphenyl)benzamide (PubChem CID 26178121) has the molecular formula C16H16FNO and a molecular weight of 257.31 g/mol. Its IUPAC name is 3-fluoro-N-(4-propylphenyl)benzamide.

Molecular Properties

Compound Name3-fluoro-N-(4-propylphenyl)benzamide
PubChem CID26178121
Molecular FormulaC16H16FNO
Molecular Weight257.31 g/mol
Exact Mass257.12
IUPAC Name3-fluoro-N-(4-propylphenyl)benzamide
SMILESCCCc1ccc(NC(=O)c2cccc(F)c2)cc1
InChIInChI=1S/C16H16FNO/c1-2-4-12-7-9-15(10-8-12)18-16(19)13-5-3-6-14(17)11-13/h3,5-11H,2,4H2,1H3,(H,18,19)
InChIKeyDUBUNWKXQWWIEC-UHFFFAOYSA-N
XLogP4.03
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-fluorophenyl)-3-propylbenzamide
CID 67124945
diethyl-[[4-[(3-fluorobenzoyl)amino]phenyl]methyl]azanium
CID 7470003
2-[4-[(3-fluorobenzoyl)amino]phenyl]acetic acid
CID 16792926
N-[(4-butylphenyl)carbamothioyl]-3-fluorobenzamide
CID 2279604
3-nitro-N-(4-propylphenyl)benzamide
CID 8803025
3-fluoro-N-[4-(2-methylpropylamino)phenyl]benzamide
CID 112980338
3-fluoro-N-[4-(hydroxycarbamoyl)phenyl]benzamide
CID 90480202
N-[4-(diethylsulfamoyl)phenyl]-3-fluorobenzamide
CID 3643564
3-(benzylcarbamoylamino)-N-(4-propylphenyl)benzamide
CID 20667039
3-N-(4-ethylphenyl)-1-N-propylbenzene-1,3-dicarboxamide
CID 109050379
(4-propylphenyl) 3-fluorobenzoate
CID 19175128
4-fluoro-3-nitro-N-(4-propylphenyl)benzamide
CID 8732756

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(4-propylphenyl)benzamide?
The IUPAC name of 3-fluoro-N-(4-propylphenyl)benzamide (CID 26178121) is 3-fluoro-N-(4-propylphenyl)benzamide.
What is the SMILES notation for 3-fluoro-N-(4-propylphenyl)benzamide?
The canonical SMILES for 3-fluoro-N-(4-propylphenyl)benzamide is CCCc1ccc(NC(=O)c2cccc(F)c2)cc1.
What is the InChIKey of 3-fluoro-N-(4-propylphenyl)benzamide?
The InChIKey is DUBUNWKXQWWIEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO/c1-2-4-12-7-9-15(10-8-12)18-16(19)13-5-3-6-14(17)11-13/h3,5-11H,2,4H2,1H3,(H,18,19).
What are the key properties of 3-fluoro-N-(4-propylphenyl)benzamide?
3-fluoro-N-(4-propylphenyl)benzamide has a molecular weight of 257.31 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(4-propylphenyl)benzamide is sourced from PubChem (CID 26178121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).