2-fluoro-5-(furan-2-yl)-N-methylbenzamide

C12H10FNO2 — CID 168525507

IUPAC2-fluoro-5-(furan-2-yl)-N-methylbenzamide
SMILESCNC(=O)c1cc(-c2ccco2)ccc1F
InChIInChI=1S/C12H10FNO2/c1-14-12(15)9-7-8(4-5-10(9)13)11-3-2-6-16-11/h2-7H,1H3,(H,14,15)
InChIKeyZSFNOGBTYUIPAQ-UHFFFAOYSA-N
MW219.21 g/mol
LogP2.45
Rot. Bonds2

About 2-fluoro-5-(furan-2-yl)-N-methylbenzamide

2-fluoro-5-(furan-2-yl)-N-methylbenzamide (PubChem CID 168525507) has the molecular formula C12H10FNO2 and a molecular weight of 219.21 g/mol. Its IUPAC name is 2-fluoro-5-(furan-2-yl)-N-methylbenzamide.

Molecular Properties

Compound Name2-fluoro-5-(furan-2-yl)-N-methylbenzamide
PubChem CID168525507
Molecular FormulaC12H10FNO2
Molecular Weight219.21 g/mol
Exact Mass219.07
IUPAC Name2-fluoro-5-(furan-2-yl)-N-methylbenzamide
SMILESCNC(=O)c1cc(-c2ccco2)ccc1F
InChIInChI=1S/C12H10FNO2/c1-14-12(15)9-7-8(4-5-10(9)13)11-3-2-6-16-11/h2-7H,1H3,(H,14,15)
InChIKeyZSFNOGBTYUIPAQ-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 ≤ 500219.21
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-(furan-2-yl)-N-methylbenzamide?
The IUPAC name of 2-fluoro-5-(furan-2-yl)-N-methylbenzamide (CID 168525507) is 2-fluoro-5-(furan-2-yl)-N-methylbenzamide.
What is the SMILES notation for 2-fluoro-5-(furan-2-yl)-N-methylbenzamide?
The canonical SMILES for 2-fluoro-5-(furan-2-yl)-N-methylbenzamide is CNC(=O)c1cc(-c2ccco2)ccc1F.
What is the InChIKey of 2-fluoro-5-(furan-2-yl)-N-methylbenzamide?
The InChIKey is ZSFNOGBTYUIPAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FNO2/c1-14-12(15)9-7-8(4-5-10(9)13)11-3-2-6-16-11/h2-7H,1H3,(H,14,15).
What are the key properties of 2-fluoro-5-(furan-2-yl)-N-methylbenzamide?
2-fluoro-5-(furan-2-yl)-N-methylbenzamide has a molecular weight of 219.21 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 2-fluoro-5-(furan-2-yl)-N-methylbenzamide is sourced from PubChem (CID 168525507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).