5-methyl-2-(trifluoromethyl)furan-3-carboxamide

C7H6F3NO2 — CID 2775640

IUPAC5-methyl-2-(trifluoromethyl)furan-3-carboxamide
SMILESCc1cc(C(N)=O)c(C(F)(F)F)o1
InChIInChI=1S/C7H6F3NO2/c1-3-2-4(6(11)12)5(13-3)7(8,9)10/h2H,1H3,(H2,11,12)
InChIKeyNXCKENOPYUWPSU-UHFFFAOYSA-N
MW193.12 g/mol
LogP1.71
Rot. Bonds1

About 5-methyl-2-(trifluoromethyl)furan-3-carboxamide

5-methyl-2-(trifluoromethyl)furan-3-carboxamide (PubChem CID 2775640) has the molecular formula C7H6F3NO2 and a molecular weight of 193.12 g/mol. Its IUPAC name is 5-methyl-2-(trifluoromethyl)furan-3-carboxamide.

Molecular Properties

Compound Name5-methyl-2-(trifluoromethyl)furan-3-carboxamide
PubChem CID2775640
Molecular FormulaC7H6F3NO2
Molecular Weight193.12 g/mol
Exact Mass193.04
IUPAC Name5-methyl-2-(trifluoromethyl)furan-3-carboxamide
SMILESCc1cc(C(N)=O)c(C(F)(F)F)o1
InChIInChI=1S/C7H6F3NO2/c1-3-2-4(6(11)12)5(13-3)7(8,9)10/h2H,1H3,(H2,11,12)
InChIKeyNXCKENOPYUWPSU-UHFFFAOYSA-N
XLogP1.71
TPSA56.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.12
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(trifluoromethyl)furan-3-carboxamide?
The IUPAC name of 5-methyl-2-(trifluoromethyl)furan-3-carboxamide (CID 2775640) is 5-methyl-2-(trifluoromethyl)furan-3-carboxamide.
What is the SMILES notation for 5-methyl-2-(trifluoromethyl)furan-3-carboxamide?
The canonical SMILES for 5-methyl-2-(trifluoromethyl)furan-3-carboxamide is Cc1cc(C(N)=O)c(C(F)(F)F)o1.
What is the InChIKey of 5-methyl-2-(trifluoromethyl)furan-3-carboxamide?
The InChIKey is NXCKENOPYUWPSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3NO2/c1-3-2-4(6(11)12)5(13-3)7(8,9)10/h2H,1H3,(H2,11,12).
What are the key properties of 5-methyl-2-(trifluoromethyl)furan-3-carboxamide?
5-methyl-2-(trifluoromethyl)furan-3-carboxamide has a molecular weight of 193.12 g/mol, XLogP of 1.71, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(trifluoromethyl)furan-3-carboxamide is sourced from PubChem (CID 2775640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).