N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide

C21H21NO3 — CID 16650745

IUPACN-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cc(-c2ccc(C)cc2)oc1C
InChIInChI=1S/C21H21NO3/c1-4-24-19-8-6-5-7-18(19)22-21(23)17-13-20(25-15(17)3)16-11-9-14(2)10-12-16/h5-13H,4H2,1-3H3,(H,22,23)
InChIKeyNIPHMUYJGDJDJS-UHFFFAOYSA-N
MW335.40 g/mol
LogP5.21
Rot. Bonds5

About N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide

N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide (PubChem CID 16650745) has the molecular formula C21H21NO3 and a molecular weight of 335.40 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide
PubChem CID16650745
Molecular FormulaC21H21NO3
Molecular Weight335.40 g/mol
Exact Mass335.15
IUPAC NameN-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cc(-c2ccc(C)cc2)oc1C
InChIInChI=1S/C21H21NO3/c1-4-24-19-8-6-5-7-18(19)22-21(23)17-13-20(25-15(17)3)16-11-9-14(2)10-12-16/h5-13H,4H2,1-3H3,(H,22,23)
InChIKeyNIPHMUYJGDJDJS-UHFFFAOYSA-N
XLogP5.21
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.40
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide
CID 16650861
N-(2-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide
CID 2742801
2,4-diethoxy-N-(2-ethoxyphenyl)benzamide
CID 17340647
N-(2-ethoxyphenyl)-2,4,6-trimethylbenzamide
CID 17060500
N-(2-ethoxyphenyl)-2-iodobenzamide
CID 996130
5-(4-bromophenyl)-N-(4-ethoxyphenyl)-2-methylfuran-3-carboxamide
CID 16651497
N-(2-ethoxyphenyl)-1,3-dimethylpyrazole-4-carboxamide
CID 42352848
1-N,3-N-bis(2-ethoxyphenyl)-4-methoxybenzene-1,3-dicarboxamide
CID 141155437
2-ethoxy-N-[4-[4-[(2-ethoxybenzoyl)amino]-3-methylphenyl]-2-methylphenyl]benzamide
CID 4556792
5-amino-2,3-dichloro-N-(2-ethoxyphenyl)benzamide
CID 107183316
2-(4-methylphenyl)-4-[(2-methyl-5-phenylfuran-3-carbonyl)amino]thiophene-3-carboxylic acid
CID 58191222
N-(2-ethoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 15943045

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide (CID 16650745) is N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide is CCOc1ccccc1NC(=O)c1cc(-c2ccc(C)cc2)oc1C.
What is the InChIKey of N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide?
The InChIKey is NIPHMUYJGDJDJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO3/c1-4-24-19-8-6-5-7-18(19)22-21(23)17-13-20(25-15(17)3)16-11-9-14(2)10-12-16/h5-13H,4H2,1-3H3,(H,22,23).
What are the key properties of N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide?
N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide has a molecular weight of 335.40 g/mol, XLogP of 5.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide is sourced from PubChem (CID 16650745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).