5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide

C22H23NO5 — CID 35529730

IUPAC5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide
SMILESCOc1ccc([C@@H](C)NC(=O)c2ccc(COc3ccccc3OC)o2)cc1
InChIInChI=1S/C22H23NO5/c1-15(16-8-10-17(25-2)11-9-16)23-22(24)21-13-12-18(28-21)14-27-20-7-5-4-6-19(20)26-3/h4-13,15H,14H2,1-3H3,(H,23,24)/t15-/m1/s1
InChIKeyFNGHSQBKJXSSNH-OAHLLOKOSA-N
MW381.43 g/mol
LogP4.37
Rot. Bonds8

About 5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide

5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide (PubChem CID 35529730) has the molecular formula C22H23NO5 and a molecular weight of 381.43 g/mol. Its IUPAC name is 5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide
PubChem CID35529730
Molecular FormulaC22H23NO5
Molecular Weight381.43 g/mol
Exact Mass381.16
IUPAC Name5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide
SMILESCOc1ccc([C@@H](C)NC(=O)c2ccc(COc3ccccc3OC)o2)cc1
InChIInChI=1S/C22H23NO5/c1-15(16-8-10-17(25-2)11-9-16)23-22(24)21-13-12-18(28-21)14-27-20-7-5-4-6-19(20)26-3/h4-13,15H,14H2,1-3H3,(H,23,24)/t15-/m1/s1
InChIKeyFNGHSQBKJXSSNH-OAHLLOKOSA-N
XLogP4.37
TPSA69.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.43
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide?
The IUPAC name of 5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide (CID 35529730) is 5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide.
What is the SMILES notation for 5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide?
The canonical SMILES for 5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide is COc1ccc([C@@H](C)NC(=O)c2ccc(COc3ccccc3OC)o2)cc1.
What is the InChIKey of 5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide?
The InChIKey is FNGHSQBKJXSSNH-OAHLLOKOSA-N. The full InChI is InChI=1S/C22H23NO5/c1-15(16-8-10-17(25-2)11-9-16)23-22(24)21-13-12-18(28-21)14-27-20-7-5-4-6-19(20)26-3/h4-13,15H,14H2,1-3H3,(H,23,24)/t15-/m1/s1.
What are the key properties of 5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide?
5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide has a molecular weight of 381.43 g/mol, XLogP of 4.37, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide is sourced from PubChem (CID 35529730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).