2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide

C16H22FNO — CID 151103290

IUPAC2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide
SMILESC=CCCCCC[C@H](C)NC(=O)c1ccccc1F
InChIInChI=1S/C16H22FNO/c1-3-4-5-6-7-10-13(2)18-16(19)14-11-8-9-12-15(14)17/h3,8-9,11-13H,1,4-7,10H2,2H3,(H,18,19)/t13-/m0/s1
InChIKeyMOOIOMOTJUEONZ-ZDUSSCGKSA-N
MW263.36 g/mol
LogP4.08
Rot. Bonds8

About 2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide

2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide (PubChem CID 151103290) has the molecular formula C16H22FNO and a molecular weight of 263.36 g/mol. Its IUPAC name is 2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide
PubChem CID151103290
Molecular FormulaC16H22FNO
Molecular Weight263.36 g/mol
Exact Mass263.17
IUPAC Name2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide
SMILESC=CCCCCC[C@H](C)NC(=O)c1ccccc1F
InChIInChI=1S/C16H22FNO/c1-3-4-5-6-7-10-13(2)18-16(19)14-11-8-9-12-15(14)17/h3,8-9,11-13H,1,4-7,10H2,2H3,(H,18,19)/t13-/m0/s1
InChIKeyMOOIOMOTJUEONZ-ZDUSSCGKSA-N
XLogP4.08
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide?
The IUPAC name of 2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide (CID 151103290) is 2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide.
What is the SMILES notation for 2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide?
The canonical SMILES for 2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide is C=CCCCCC[C@H](C)NC(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide?
The InChIKey is MOOIOMOTJUEONZ-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H22FNO/c1-3-4-5-6-7-10-13(2)18-16(19)14-11-8-9-12-15(14)17/h3,8-9,11-13H,1,4-7,10H2,2H3,(H,18,19)/t13-/m0/s1.
What are the key properties of 2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide?
2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide has a molecular weight of 263.36 g/mol, XLogP of 4.08, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[(2S)-non-8-en-2-yl]benzamide is sourced from PubChem (CID 151103290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).