5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide

C14H14FNO2 — CID 46422285

IUPAC5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide
SMILESCCc1ccc(C(=O)Nc2ccc(C)c(F)c2)o1
InChIInChI=1S/C14H14FNO2/c1-3-11-6-7-13(18-11)14(17)16-10-5-4-9(2)12(15)8-10/h4-8H,3H2,1-2H3,(H,16,17)
InChIKeyBEPITLOPEWVBOV-UHFFFAOYSA-N
MW247.27 g/mol
LogP3.54
Rot. Bonds3

About 5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide

5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide (PubChem CID 46422285) has the molecular formula C14H14FNO2 and a molecular weight of 247.27 g/mol. Its IUPAC name is 5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide
PubChem CID46422285
Molecular FormulaC14H14FNO2
Molecular Weight247.27 g/mol
Exact Mass247.10
IUPAC Name5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide
SMILESCCc1ccc(C(=O)Nc2ccc(C)c(F)c2)o1
InChIInChI=1S/C14H14FNO2/c1-3-11-6-7-13(18-11)14(17)16-10-5-4-9(2)12(15)8-10/h4-8H,3H2,1-2H3,(H,16,17)
InChIKeyBEPITLOPEWVBOV-UHFFFAOYSA-N
XLogP3.54
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.27
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-N-(3-fluorophenyl)furan-2-carboxamide
CID 110697812
5-ethyl-N-[4-(hydroxymethyl)phenyl]furan-2-carboxamide
CID 64793917
N-[4-amino-3-(trifluoromethyl)phenyl]-5-ethylfuran-2-carboxamide
CID 79095580
N-(4-amino-3-methoxyphenyl)-5-ethylfuran-2-carboxamide
CID 79094156
N-(3-bromo-5-methylphenyl)-5-ethylfuran-2-carboxamide
CID 104938590
N-[4-(cyanomethyl)phenyl]-5-ethylfuran-2-carboxamide
CID 112726762
N-(4-chloro-3-fluorophenyl)-5-(methoxymethyl)furan-2-carboxamide
CID 78882500
5-ethyl-N-[4-[(propan-2-ylamino)methyl]phenyl]furan-2-carboxamide
CID 106910472
2-[(5-ethylfuran-2-carbonyl)amino]-5-fluorobenzoic acid
CID 43172269
5-(methoxymethyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]furan-2-carboxamide
CID 86913717
N-(3,4-dimethylphenyl)-5-[(4-methylphenoxy)methyl]furan-2-carboxamide
CID 18830628
N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide
CID 112557315

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide?
The IUPAC name of 5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide (CID 46422285) is 5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide is CCc1ccc(C(=O)Nc2ccc(C)c(F)c2)o1.
What is the InChIKey of 5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide?
The InChIKey is BEPITLOPEWVBOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO2/c1-3-11-6-7-13(18-11)14(17)16-10-5-4-9(2)12(15)8-10/h4-8H,3H2,1-2H3,(H,16,17).
What are the key properties of 5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide?
5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide has a molecular weight of 247.27 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(3-fluoro-4-methylphenyl)furan-2-carboxamide is sourced from PubChem (CID 46422285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).