N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide

C23H25NO4 — CID 19446544

IUPACN-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(COc3ccc(C(C)C)cc3)o2)cc1
InChIInChI=1S/C23H25NO4/c1-4-26-19-11-7-18(8-12-19)24-23(25)22-14-13-21(28-22)15-27-20-9-5-17(6-10-20)16(2)3/h5-14,16H,4,15H2,1-3H3,(H,24,25)
InChIKeyXTWJKAXXSLCBAG-UHFFFAOYSA-N
MW379.46 g/mol
LogP5.63
Rot. Bonds8

About N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide

N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide (PubChem CID 19446544) has the molecular formula C23H25NO4 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
PubChem CID19446544
Molecular FormulaC23H25NO4
Molecular Weight379.46 g/mol
Exact Mass379.18
IUPAC NameN-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(COc3ccc(C(C)C)cc3)o2)cc1
InChIInChI=1S/C23H25NO4/c1-4-26-19-11-7-18(8-12-19)24-23(25)22-14-13-21(28-22)15-27-20-9-5-17(6-10-20)16(2)3/h5-14,16H,4,15H2,1-3H3,(H,24,25)
InChIKeyXTWJKAXXSLCBAG-UHFFFAOYSA-N
XLogP5.63
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.46
LogP ≤ 55.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 19448207
5-[(4-butan-2-ylphenoxy)methyl]-N-(4-ethylphenyl)furan-2-carboxamide
CID 19450467
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 26774462
N-(4-ethoxyphenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 19467513
5-(1,3-benzodioxol-5-yloxymethyl)-N-(4-ethoxyphenyl)furan-2-carboxamide
CID 19463936
4-ethoxy-N-(4-propan-2-ylphenyl)benzamide
CID 673574
5-[(4-ethoxyphenoxy)methyl]furan-2-carbohydrazide
CID 5104781
N-(2-methoxyethyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 19448238
N-cyclopropyl-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 19446522
N-[4-(difluoromethoxy)-3-ethoxyphenyl]-5-[(4-ethoxyphenoxy)methyl]furan-2-carboxamide
CID 19413402
N-(4-acetamidophenyl)-5-[(4-acetylphenoxy)methyl]furan-2-carboxamide
CID 19455187
N-[1-(4-butan-2-ylphenyl)propyl]-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 19448118

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide (CID 19446544) is N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide is CCOc1ccc(NC(=O)c2ccc(COc3ccc(C(C)C)cc3)o2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide?
The InChIKey is XTWJKAXXSLCBAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO4/c1-4-26-19-11-7-18(8-12-19)24-23(25)22-14-13-21(28-22)15-27-20-9-5-17(6-10-20)16(2)3/h5-14,16H,4,15H2,1-3H3,(H,24,25).
What are the key properties of N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide?
N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide has a molecular weight of 379.46 g/mol, XLogP of 5.63, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 19446544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).