5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide

C10H11FN2O2 — CID 126787460

IUPAC5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide
SMILESCC(C)(CF)NC(=O)c1ccc(C#N)o1
InChIInChI=1S/C10H11FN2O2/c1-10(2,6-11)13-9(14)8-4-3-7(5-12)15-8/h3-4H,6H2,1-2H3,(H,13,14)
InChIKeyAEXDNPIBYHDVTB-UHFFFAOYSA-N
MW210.21 g/mol
LogP1.63
Rot. Bonds3

About 5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide

5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide (PubChem CID 126787460) has the molecular formula C10H11FN2O2 and a molecular weight of 210.21 g/mol. Its IUPAC name is 5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide
PubChem CID126787460
Molecular FormulaC10H11FN2O2
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC Name5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide
SMILESCC(C)(CF)NC(=O)c1ccc(C#N)o1
InChIInChI=1S/C10H11FN2O2/c1-10(2,6-11)13-9(14)8-4-3-7(5-12)15-8/h3-4H,6H2,1-2H3,(H,13,14)
InChIKeyAEXDNPIBYHDVTB-UHFFFAOYSA-N
XLogP1.63
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-5-methylfuran-2-carboxamide
CID 897030
N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl]-2-furamide
CID 2962360
N-(2-cyanopropan-2-yl)furan-2-carboxamide
CID 565206
2-Furancarboxamide, N-(2-((2,2-dicyano-1-(methylamino)ethenyl)amino)ethyl)-5-((dimethylamino)methyl)-
CID 3077647
N-methyl-5-[(methylamino)methyl]furan-2-carboxamide
CID 50989062
5-bromo-N-(2-methylbutan-2-yl)furan-2-carboxamide
CID 845105
N-(tert-butyl)-5-[(2,2,2-trifluoroethoxy)methyl]-2-furamide
CID 891927
Cambridge id 6626091
CID 2906094
5-(aminomethyl)-N-methylfuran-2-carboxamide
CID 44141692
2-Furancarboxamide, N-(aminocarbonyl)-5-methyl-
CID 212315
5-[(diisopropylamino)methyl]-N-methyl-2-furamide hydrochloride
CID 745031
N-[2-(cyclohex-1-en-1-yl)ethyl]-5-methylfuran-2-carboxamide
CID 3783093

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide?
The IUPAC name of 5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide (CID 126787460) is 5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide.
What is the SMILES notation for 5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide?
The canonical SMILES for 5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide is CC(C)(CF)NC(=O)c1ccc(C#N)o1.
What is the InChIKey of 5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide?
The InChIKey is AEXDNPIBYHDVTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O2/c1-10(2,6-11)13-9(14)8-4-3-7(5-12)15-8/h3-4H,6H2,1-2H3,(H,13,14).
What are the key properties of 5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide?
5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide has a molecular weight of 210.21 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-(1-fluoro-2-methylpropan-2-yl)furan-2-carboxamide is sourced from PubChem (CID 126787460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).