4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide

C22H18N2O3 — CID 46942743

IUPAC4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)c1cccc(-c2ccnc3c2CC(C(=O)Nc2ccccc2)O3)c1
InChIInChI=1S/C22H18N2O3/c1-14(25)15-6-5-7-16(12-15)18-10-11-23-22-19(18)13-20(27-22)21(26)24-17-8-3-2-4-9-17/h2-12,20H,13H2,1H3,(H,24,26)
InChIKeyHWWALCOSLSUKHJ-UHFFFAOYSA-N
MW358.40 g/mol
LogP3.89
Rot. Bonds4

About 4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide

4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (PubChem CID 46942743) has the molecular formula C22H18N2O3 and a molecular weight of 358.40 g/mol. Its IUPAC name is 4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
PubChem CID46942743
Molecular FormulaC22H18N2O3
Molecular Weight358.40 g/mol
Exact Mass358.13
IUPAC Name4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)c1cccc(-c2ccnc3c2CC(C(=O)Nc2ccccc2)O3)c1
InChIInChI=1S/C22H18N2O3/c1-14(25)15-6-5-7-16(12-15)18-10-11-23-22-19(18)13-20(27-22)21(26)24-17-8-3-2-4-9-17/h2-12,20H,13H2,1H3,(H,24,26)
InChIKeyHWWALCOSLSUKHJ-UHFFFAOYSA-N
XLogP3.89
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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US9914740, VIII-8
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CID 70665375
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Frequently Asked Questions

What is the IUPAC name of 4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (CID 46942743) is 4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is CC(=O)c1cccc(-c2ccnc3c2CC(C(=O)Nc2ccccc2)O3)c1.
What is the InChIKey of 4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The InChIKey is HWWALCOSLSUKHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O3/c1-14(25)15-6-5-7-16(12-15)18-10-11-23-22-19(18)13-20(27-22)21(26)24-17-8-3-2-4-9-17/h2-12,20H,13H2,1H3,(H,24,26).
What are the key properties of 4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide has a molecular weight of 358.40 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-acetylphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 46942743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).