N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide

C20H18FNO3 — CID 19467243

IUPACN-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
SMILESCc1cccc(OCc2ccc(C(=O)Nc3cc(C)ccc3F)o2)c1
InChIInChI=1S/C20H18FNO3/c1-13-4-3-5-15(10-13)24-12-16-7-9-19(25-16)20(23)22-18-11-14(2)6-8-17(18)21/h3-11H,12H2,1-2H3,(H,22,23)
InChIKeyQOZQSRNTXLPMKG-UHFFFAOYSA-N
MW339.37 g/mol
LogP4.87
Rot. Bonds5

About N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide

N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide (PubChem CID 19467243) has the molecular formula C20H18FNO3 and a molecular weight of 339.37 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
PubChem CID19467243
Molecular FormulaC20H18FNO3
Molecular Weight339.37 g/mol
Exact Mass339.13
IUPAC NameN-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
SMILESCc1cccc(OCc2ccc(C(=O)Nc3cc(C)ccc3F)o2)c1
InChIInChI=1S/C20H18FNO3/c1-13-4-3-5-15(10-13)24-12-16-7-9-19(25-16)20(23)22-18-11-14(2)6-8-17(18)21/h3-11H,12H2,1-2H3,(H,22,23)
InChIKeyQOZQSRNTXLPMKG-UHFFFAOYSA-N
XLogP4.87
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(4-acetylphenoxy)methyl]-N-(2-fluoro-5-methylphenyl)furan-2-carboxamide
CID 19455249
N-(2-fluoro-5-methylphenyl)-5-[(2-methylphenoxy)methyl]furan-2-carboxamide
CID 19455034
N-(2,6-dimethylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
CID 19465597
5-[(3-methylphenoxy)methyl]-N-(2-phenylsulfanylphenyl)furan-2-carboxamide
CID 19465579
N-(3-methylphenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 7464174
5-[(2-chloro-5-nitrophenoxy)methyl]-N-(2-fluoro-5-methylphenyl)furan-2-carboxamide
CID 19459513
5-[(3-methylphenoxy)methyl]-N-(2-methylpropyl)furan-2-carboxamide
CID 19467228
N-(2,4-dichlorophenyl)-5-[(4-methylphenoxy)methyl]furan-2-carboxamide
CID 18830642
5-[(4-bromophenoxy)methyl]-N-(2,5-dimethylphenyl)furan-2-carboxamide
CID 19413541
N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide
CID 19446073
2-hydroxy-4-[[5-[(3-methylphenoxy)methyl]furan-2-carbonyl]amino]benzoic acid
CID 4899963
N-[4-chloro-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
CID 19467344

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide (CID 19467243) is N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide is Cc1cccc(OCc2ccc(C(=O)Nc3cc(C)ccc3F)o2)c1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide?
The InChIKey is QOZQSRNTXLPMKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FNO3/c1-13-4-3-5-15(10-13)24-12-16-7-9-19(25-16)20(23)22-18-11-14(2)6-8-17(18)21/h3-11H,12H2,1-2H3,(H,22,23).
What are the key properties of N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide?
N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide has a molecular weight of 339.37 g/mol, XLogP of 4.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 19467243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).