3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide

C20H15FN2O — CID 4824000

IUPAC3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide
SMILESO=C(Nc1cccc(C=Cc2ccccn2)c1)c1cccc(F)c1
InChIInChI=1S/C20H15FN2O/c21-17-7-4-6-16(14-17)20(24)23-19-9-3-5-15(13-19)10-11-18-8-1-2-12-22-18/h1-14H,(H,23,24)
InChIKeyUFPRMLGGHIGXBO-UHFFFAOYSA-N
MW318.35 g/mol
LogP4.64
Rot. Bonds4

About 3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide

3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide (PubChem CID 4824000) has the molecular formula C20H15FN2O and a molecular weight of 318.35 g/mol. Its IUPAC name is 3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide.

Molecular Properties

Compound Name3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide
PubChem CID4824000
Molecular FormulaC20H15FN2O
Molecular Weight318.35 g/mol
Exact Mass318.12
IUPAC Name3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide
SMILESO=C(Nc1cccc(C=Cc2ccccn2)c1)c1cccc(F)c1
InChIInChI=1S/C20H15FN2O/c21-17-7-4-6-16(14-17)20(24)23-19-9-3-5-15(13-19)10-11-18-8-1-2-12-22-18/h1-14H,(H,23,24)
InChIKeyUFPRMLGGHIGXBO-UHFFFAOYSA-N
XLogP4.64
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.35
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]benzamide
CID 8751018
4-cyano-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide
CID 4823960
5-fluoro-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]-1H-indole-2-carboxamide
CID 39984636
2-bromo-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]benzamide
CID 8751013
2-acetamido-4,5-dimethoxy-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]benzamide
CID 9108507
N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrimidin-2-amine
CID 18093346
3-acetamido-N-(3-fluorophenyl)benzamide
CID 2443243
(E)-3-[2-[(3-fluorobenzoyl)amino]-4-pyridinyl]prop-2-enoic acid
CID 102822099
3-fluoro-N-[3-[[3-(3-fluorophenyl)prop-2-enoylamino]methyl]phenyl]benzamide
CID 55894437
[3-[(3-fluorobenzoyl)amino]phenyl]boronic acid
CID 131251143
N-[3-[(3-fluorobenzoyl)amino]phenyl]-3-methylbenzamide
CID 46785922
N-[6-(3-acetylanilino)-3-pyridinyl]-3-fluorobenzamide
CID 113020314

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide?
The IUPAC name of 3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide (CID 4824000) is 3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide.
What is the SMILES notation for 3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide?
The canonical SMILES for 3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide is O=C(Nc1cccc(C=Cc2ccccn2)c1)c1cccc(F)c1.
What is the InChIKey of 3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide?
The InChIKey is UFPRMLGGHIGXBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN2O/c21-17-7-4-6-16(14-17)20(24)23-19-9-3-5-15(13-19)10-11-18-8-1-2-12-22-18/h1-14H,(H,23,24).
What are the key properties of 3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide?
3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide has a molecular weight of 318.35 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[3-(2-pyridin-2-ylethenyl)phenyl]benzamide is sourced from PubChem (CID 4824000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).