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

C24H22N2O3 — CID 46942701

IUPAC4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)c1cccc(-c2ccnc3c2CC(C(=O)NCCc2ccccc2)O3)c1
InChIInChI=1S/C24H22N2O3/c1-16(27)18-8-5-9-19(14-18)20-11-13-26-24-21(20)15-22(29-24)23(28)25-12-10-17-6-3-2-4-7-17/h2-9,11,13-14,22H,10,12,15H2,1H3,(H,25,28)
InChIKeyOYMDZBJCNLXOSM-UHFFFAOYSA-N
MW386.45 g/mol
LogP3.61
Rot. Bonds6

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

4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (PubChem CID 46942701) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is 4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
PubChem CID46942701
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)c1cccc(-c2ccnc3c2CC(C(=O)NCCc2ccccc2)O3)c1
InChIInChI=1S/C24H22N2O3/c1-16(27)18-8-5-9-19(14-18)20-11-13-26-24-21(20)15-22(29-24)23(28)25-12-10-17-6-3-2-4-7-17/h2-9,11,13-14,22H,10,12,15H2,1H3,(H,25,28)
InChIKeyOYMDZBJCNLXOSM-UHFFFAOYSA-N
XLogP3.61
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (CID 46942701) is 4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is CC(=O)c1cccc(-c2ccnc3c2CC(C(=O)NCCc2ccccc2)O3)c1.
What is the InChIKey of 4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The InChIKey is OYMDZBJCNLXOSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O3/c1-16(27)18-8-5-9-19(14-18)20-11-13-26-24-21(20)15-22(29-24)23(28)25-12-10-17-6-3-2-4-7-17/h2-9,11,13-14,22H,10,12,15H2,1H3,(H,25,28).
What are the key properties of 4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide has a molecular weight of 386.45 g/mol, XLogP of 3.61, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-acetylphenyl)-N-(2-phenylethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 46942701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).