4-fluoro-N-(1-phenylbutyl)benzamide

C17H18FNO — CID 60657146

IUPAC4-fluoro-N-(1-phenylbutyl)benzamide
SMILESCCCC(NC(=O)c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C17H18FNO/c1-2-6-16(13-7-4-3-5-8-13)19-17(20)14-9-11-15(18)12-10-14/h3-5,7-12,16H,2,6H2,1H3,(H,19,20)
InChIKeyYAHWYWGBHAGKGR-UHFFFAOYSA-N
MW271.34 g/mol
LogP4.10
Rot. Bonds5

About 4-fluoro-N-(1-phenylbutyl)benzamide

4-fluoro-N-(1-phenylbutyl)benzamide (PubChem CID 60657146) has the molecular formula C17H18FNO and a molecular weight of 271.34 g/mol. Its IUPAC name is 4-fluoro-N-(1-phenylbutyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(1-phenylbutyl)benzamide
PubChem CID60657146
Molecular FormulaC17H18FNO
Molecular Weight271.34 g/mol
Exact Mass271.14
IUPAC Name4-fluoro-N-(1-phenylbutyl)benzamide
SMILESCCCC(NC(=O)c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C17H18FNO/c1-2-6-16(13-7-4-3-5-8-13)19-17(20)14-9-11-15(18)12-10-14/h3-5,7-12,16H,2,6H2,1H3,(H,19,20)
InChIKeyYAHWYWGBHAGKGR-UHFFFAOYSA-N
XLogP4.10
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-fluoro-N-[(1R)-1-phenylpentyl]benzamide
CID 2201408
4-fluoro-N-[(1S)-1-phenylpropyl]benzamide
CID 781115
4-fluoro-N-(2-hydroxy-1-phenylethyl)benzamide
CID 63184399
4-bromo-3-fluoro-N-(1-phenylbutyl)benzamide
CID 63524586
1-N,4-N-bis(1-phenylpropyl)benzene-1,4-dicarboxamide
CID 43912072
2-amino-5-fluoro-N-(1-phenylbutyl)benzamide
CID 43708581
2-bromo-5-fluoro-N-(1-phenylbutyl)benzamide
CID 60667425
4-(2-methyltetrazol-5-yl)-N-[(1R)-1-phenylbutyl]benzamide
CID 29116117
3-bromo-N-(1-phenylbutyl)benzamide
CID 60654945
(3R)-3-benzamido-3-(4-fluorophenyl)propanoic acid
CID 717556
3-bromo-4-methyl-N-(1-phenylbutyl)benzamide
CID 81457666
2-(4-fluoroanilino)-N-(1-phenylbutyl)propanamide
CID 134030963

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(1-phenylbutyl)benzamide?
The IUPAC name of 4-fluoro-N-(1-phenylbutyl)benzamide (CID 60657146) is 4-fluoro-N-(1-phenylbutyl)benzamide.
What is the SMILES notation for 4-fluoro-N-(1-phenylbutyl)benzamide?
The canonical SMILES for 4-fluoro-N-(1-phenylbutyl)benzamide is CCCC(NC(=O)c1ccc(F)cc1)c1ccccc1.
What is the InChIKey of 4-fluoro-N-(1-phenylbutyl)benzamide?
The InChIKey is YAHWYWGBHAGKGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO/c1-2-6-16(13-7-4-3-5-8-13)19-17(20)14-9-11-15(18)12-10-14/h3-5,7-12,16H,2,6H2,1H3,(H,19,20).
What are the key properties of 4-fluoro-N-(1-phenylbutyl)benzamide?
4-fluoro-N-(1-phenylbutyl)benzamide has a molecular weight of 271.34 g/mol, XLogP of 4.10, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(1-phenylbutyl)benzamide is sourced from PubChem (CID 60657146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).