2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide

C18H13F2NO2 — CID 134028235

IUPAC2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide
SMILESO=C(NC(c1ccccc1)c1ccco1)c1c(F)cccc1F
InChIInChI=1S/C18H13F2NO2/c19-13-8-4-9-14(20)16(13)18(22)21-17(15-10-5-11-23-15)12-6-2-1-3-7-12/h1-11,17H,(H,21,22)
InChIKeyXIZHJQUNCGPNRU-UHFFFAOYSA-N
MW313.30 g/mol
LogP4.08
Rot. Bonds4

About 2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide

2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide (PubChem CID 134028235) has the molecular formula C18H13F2NO2 and a molecular weight of 313.30 g/mol. Its IUPAC name is 2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide
PubChem CID134028235
Molecular FormulaC18H13F2NO2
Molecular Weight313.30 g/mol
Exact Mass313.09
IUPAC Name2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide
SMILESO=C(NC(c1ccccc1)c1ccco1)c1c(F)cccc1F
InChIInChI=1S/C18H13F2NO2/c19-13-8-4-9-14(20)16(13)18(22)21-17(15-10-5-11-23-15)12-6-2-1-3-7-12/h1-11,17H,(H,21,22)
InChIKeyXIZHJQUNCGPNRU-UHFFFAOYSA-N
XLogP4.08
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.30
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-N-[(S)-furan-2-yl(phenyl)methyl]benzamide
CID 8928171
3,5-difluoro-N-[(S)-furan-2-yl(phenyl)methyl]benzamide
CID 8928311
[furan-2-yl(phenyl)methyl]urea
CID 14906081
N-[(S)-furan-2-yl(phenyl)methyl]-4-(trifluoromethyl)benzamide
CID 8928135
N-[(R)-furan-2-yl(phenyl)methyl]-3,5-dimethylbenzamide
CID 8928204
2-bromo-N-[furan-2-yl(phenyl)methyl]furan-3-carboxamide
CID 106853210
N-[(R)-furan-2-yl(phenyl)methyl]-3-nitrobenzamide
CID 8928120
N-[(S)-furan-2-yl(phenyl)methyl]-3-nitrobenzamide
CID 8928119
3-[(2-fluorobenzoyl)amino]-N-[furan-2-yl(phenyl)methyl]-4-methylbenzamide
CID 55687173
4-(dimethylamino)-N-[furan-2-yl(phenyl)methyl]benzamide
CID 134029302
2,6-difluoro-N-[(1R)-2-hydroxy-1-phenylethyl]benzamide
CID 103944481
2,6-difluoro-N-(2-hydroxy-1-phenylethyl)benzamide
CID 63184322

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide?
The IUPAC name of 2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide (CID 134028235) is 2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide.
What is the SMILES notation for 2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide?
The canonical SMILES for 2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide is O=C(NC(c1ccccc1)c1ccco1)c1c(F)cccc1F.
What is the InChIKey of 2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide?
The InChIKey is XIZHJQUNCGPNRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F2NO2/c19-13-8-4-9-14(20)16(13)18(22)21-17(15-10-5-11-23-15)12-6-2-1-3-7-12/h1-11,17H,(H,21,22).
What are the key properties of 2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide?
2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide has a molecular weight of 313.30 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[furan-2-yl(phenyl)methyl]benzamide is sourced from PubChem (CID 134028235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).