4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide

C24H23N3O5 — CID 46944017

IUPAC4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)C2Cc3c(-c4cccc(NC(C)=O)c4)ccnc3O2)cc1OC
InChIInChI=1S/C24H23N3O5/c1-14(28)26-16-6-4-5-15(11-16)18-9-10-25-24-19(18)13-22(32-24)23(29)27-17-7-8-20(30-2)21(12-17)31-3/h4-12,22H,13H2,1-3H3,(H,26,28)(H,27,29)
InChIKeySOTHFNUQZFMXDA-UHFFFAOYSA-N
MW433.46 g/mol
LogP3.67
Rot. Bonds6

About 4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide

4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (PubChem CID 46944017) has the molecular formula C24H23N3O5 and a molecular weight of 433.46 g/mol. Its IUPAC name is 4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
PubChem CID46944017
Molecular FormulaC24H23N3O5
Molecular Weight433.46 g/mol
Exact Mass433.16
IUPAC Name4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)C2Cc3c(-c4cccc(NC(C)=O)c4)ccnc3O2)cc1OC
InChIInChI=1S/C24H23N3O5/c1-14(28)26-16-6-4-5-15(11-16)18-9-10-25-24-19(18)13-22(32-24)23(29)27-17-7-8-20(30-2)21(12-17)31-3/h4-12,22H,13H2,1-3H3,(H,26,28)(H,27,29)
InChIKeySOTHFNUQZFMXDA-UHFFFAOYSA-N
XLogP3.67
TPSA98.78 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.46
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (CID 46944017) is 4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is COc1ccc(NC(=O)C2Cc3c(-c4cccc(NC(C)=O)c4)ccnc3O2)cc1OC.
What is the InChIKey of 4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The InChIKey is SOTHFNUQZFMXDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O5/c1-14(28)26-16-6-4-5-15(11-16)18-9-10-25-24-19(18)13-22(32-24)23(29)27-17-7-8-20(30-2)21(12-17)31-3/h4-12,22H,13H2,1-3H3,(H,26,28)(H,27,29).
What are the key properties of 4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide has a molecular weight of 433.46 g/mol, XLogP of 3.67, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-acetamidophenyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 46944017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).