N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide

C20H17FN2O3 — CID 22587884

IUPACN-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide
SMILESCc1ccc(C(=O)NCc2ccc(C(=O)Nc3ccccc3F)o2)cc1
InChIInChI=1S/C20H17FN2O3/c1-13-6-8-14(9-7-13)19(24)22-12-15-10-11-18(26-15)20(25)23-17-5-3-2-4-16(17)21/h2-11H,12H2,1H3,(H,22,24)(H,23,25)
InChIKeyPTPGELFLCSRAOU-UHFFFAOYSA-N
MW352.37 g/mol
LogP3.91
Rot. Bonds5

About N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide

N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide (PubChem CID 22587884) has the molecular formula C20H17FN2O3 and a molecular weight of 352.37 g/mol. Its IUPAC name is N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide
PubChem CID22587884
Molecular FormulaC20H17FN2O3
Molecular Weight352.37 g/mol
Exact Mass352.12
IUPAC NameN-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide
SMILESCc1ccc(C(=O)NCc2ccc(C(=O)Nc3ccccc3F)o2)cc1
InChIInChI=1S/C20H17FN2O3/c1-13-6-8-14(9-7-13)19(24)22-12-15-10-11-18(26-15)20(25)23-17-5-3-2-4-16(17)21/h2-11H,12H2,1H3,(H,22,24)(H,23,25)
InChIKeyPTPGELFLCSRAOU-UHFFFAOYSA-N
XLogP3.91
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.37
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide
CID 22587881
N-(3,4-dimethylphenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide
CID 22587903
N-(2-fluorophenyl)-5-methylfuran-2-carboxamide
CID 3297570
4-N-(2,4-difluorophenyl)-1-N-[(4-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046989
N-(4-fluorophenyl)-5-[[(4-methoxybenzoyl)amino]methyl]furan-2-carboxamide
CID 22587908
1-N-[(2-fluorophenyl)methyl]-4-N-(4-methylphenyl)benzene-1,4-dicarboxamide
CID 109047183
5-[[benzyl-[(4-chlorophenyl)methyl]amino]methyl]-N-(2-fluorophenyl)furan-2-carboxamide
CID 3334338
5-[[benzyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-N-(2-fluorophenyl)furan-2-carboxamide
CID 42753793
1-N-(4-ethylphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049753
N-[(4-methylphenyl)methyl]-4-phenylbenzamide
CID 1228171
N-(2-fluoro-5-methylphenyl)-5-[(2-methylphenoxy)methyl]furan-2-carboxamide
CID 19455034
5-[(4-acetylphenoxy)methyl]-N-(2-fluoro-5-methylphenyl)furan-2-carboxamide
CID 19455249

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide (CID 22587884) is N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide is Cc1ccc(C(=O)NCc2ccc(C(=O)Nc3ccccc3F)o2)cc1.
What is the InChIKey of N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide?
The InChIKey is PTPGELFLCSRAOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O3/c1-13-6-8-14(9-7-13)19(24)22-12-15-10-11-18(26-15)20(25)23-17-5-3-2-4-16(17)21/h2-11H,12H2,1H3,(H,22,24)(H,23,25).
What are the key properties of N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide?
N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide has a molecular weight of 352.37 g/mol, XLogP of 3.91, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-5-[[(4-methylbenzoyl)amino]methyl]furan-2-carboxamide is sourced from PubChem (CID 22587884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).