3-fluoro-2-(furan-2-yl)-N-methylbenzamide

C12H10FNO2 — CID 168527432

IUPAC3-fluoro-2-(furan-2-yl)-N-methylbenzamide
SMILESCNC(=O)c1cccc(F)c1-c1ccco1
InChIInChI=1S/C12H10FNO2/c1-14-12(15)8-4-2-5-9(13)11(8)10-6-3-7-16-10/h2-7H,1H3,(H,14,15)
InChIKeyXROYKOSJCMUJID-UHFFFAOYSA-N
MW219.22 g/mol
LogP2.45
Rot. Bonds2

About 3-fluoro-2-(furan-2-yl)-N-methylbenzamide

3-fluoro-2-(furan-2-yl)-N-methylbenzamide (PubChem CID 168527432) has the molecular formula C12H10FNO2 and a molecular weight of 219.22 g/mol. Its IUPAC name is 3-fluoro-2-(furan-2-yl)-N-methylbenzamide.

Molecular Properties

Compound Name3-fluoro-2-(furan-2-yl)-N-methylbenzamide
PubChem CID168527432
Molecular FormulaC12H10FNO2
Molecular Weight219.22 g/mol
Exact Mass219.07
IUPAC Name3-fluoro-2-(furan-2-yl)-N-methylbenzamide
SMILESCNC(=O)c1cccc(F)c1-c1ccco1
InChIInChI=1S/C12H10FNO2/c1-14-12(15)8-4-2-5-9(13)11(8)10-6-3-7-16-10/h2-7H,1H3,(H,14,15)
InChIKeyXROYKOSJCMUJID-UHFFFAOYSA-N
XLogP2.45
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-2-(furan-2-yl)benzoic acid
CID 168524438
2-fluoro-5-(furan-2-yl)-N-methylbenzamide
CID 168525507
ethane;2-fluoro-N-methylbenzamide
CID 178102327
2-fluoro-N-methylbenzamide;hydrate
CID 141303255
3-fluoro-N-methyl-2-sulfanylbenzamide
CID 175999607
2-fluoro-N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]benzamide
CID 121123478
2-chloro-4-(furan-2-yl)-N-methylbenzamide
CID 168525512
2-(2-fluoro-6-propan-2-yloxyphenyl)furan
CID 168526834
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide
CID 142440284
trifluoro-[2-fluoro-3-(methylcarbamoyl)phenyl]boranuide
CID 91659200
2-(5-formylfuran-2-yl)-N,3-dimethylbenzamide
CID 169335277
ethane;2-fluoro-N-methylbenzamide;3-fluoro-N-methylbenzamide
CID 145062937

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-(furan-2-yl)-N-methylbenzamide?
The IUPAC name of 3-fluoro-2-(furan-2-yl)-N-methylbenzamide (CID 168527432) is 3-fluoro-2-(furan-2-yl)-N-methylbenzamide.
What is the SMILES notation for 3-fluoro-2-(furan-2-yl)-N-methylbenzamide?
The canonical SMILES for 3-fluoro-2-(furan-2-yl)-N-methylbenzamide is CNC(=O)c1cccc(F)c1-c1ccco1.
What is the InChIKey of 3-fluoro-2-(furan-2-yl)-N-methylbenzamide?
The InChIKey is XROYKOSJCMUJID-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FNO2/c1-14-12(15)8-4-2-5-9(13)11(8)10-6-3-7-16-10/h2-7H,1H3,(H,14,15).
What are the key properties of 3-fluoro-2-(furan-2-yl)-N-methylbenzamide?
3-fluoro-2-(furan-2-yl)-N-methylbenzamide has a molecular weight of 219.22 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(furan-2-yl)-N-methylbenzamide is sourced from PubChem (CID 168527432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).