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

C22H17FN2O3 — CID 46942698

IUPACN-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)c1cccc(NC(=O)C2Cc3c(-c4cccc(F)c4)ccnc3O2)c1
InChIInChI=1S/C22H17FN2O3/c1-13(26)14-4-3-7-17(11-14)25-21(27)20-12-19-18(8-9-24-22(19)28-20)15-5-2-6-16(23)10-15/h2-11,20H,12H2,1H3,(H,25,27)
InChIKeyBBCBYHRRUMTLNF-UHFFFAOYSA-N
MW376.39 g/mol
LogP4.03
Rot. Bonds4

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

N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (PubChem CID 46942698) has the molecular formula C22H17FN2O3 and a molecular weight of 376.39 g/mol. Its IUPAC name is N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
PubChem CID46942698
Molecular FormulaC22H17FN2O3
Molecular Weight376.39 g/mol
Exact Mass376.12
IUPAC NameN-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)c1cccc(NC(=O)C2Cc3c(-c4cccc(F)c4)ccnc3O2)c1
InChIInChI=1S/C22H17FN2O3/c1-13(26)14-4-3-7-17(11-14)25-21(27)20-12-19-18(8-9-24-22(19)28-20)15-5-2-6-16(23)10-15/h2-11,20H,12H2,1H3,(H,25,27)
InChIKeyBBCBYHRRUMTLNF-UHFFFAOYSA-N
XLogP4.03
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.39
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-oxolan-2-ylmethyl]-2,3-diphenylfuro[2,3-b]pyridin-4-amine
CID 11603130
SPHINX scaffold, 3
CID 73672854
SPHINX scaffold, 2
CID 73672855
2-(4-benzoylphenoxy)-N-pyridin-3-ylacetamide
CID 2534340
4-(4-acetamidophenyl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
CID 46942921
4-(3-acetamidophenyl)-N-(6-methoxy-3-pyridinyl)-2-methyl-3H-furo[2,3-b]pyridine-2-carboxamide
CID 49789617
5-(2-methylpropyl)-N-[4-(pyridin-4-ylmethyl)phenyl]furan-2-carboxamide
CID 5295600
5-(2-fluorophenyl)-N-(2-pyridin-3-ylethyl)furan-2-carboxamide
CID 24661244
6-(2-anilino-2-oxoethoxy)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 44285230
4-(3-acetylphenyl)-N-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
CID 46942521
4-(3-acetamidophenyl)-N-(furan-2-ylmethyl)-2-methyl-3H-furo[2,3-b]pyridine-2-carboxamide
CID 46942545
2-methyl-N-(oxan-4-ylmethyl)-4-[3-(trifluoromethyl)phenyl]-3H-furo[2,3-b]pyridine-2-carboxamide
CID 46942721

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (CID 46942698) is N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is CC(=O)c1cccc(NC(=O)C2Cc3c(-c4cccc(F)c4)ccnc3O2)c1.
What is the InChIKey of N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The InChIKey is BBCBYHRRUMTLNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17FN2O3/c1-13(26)14-4-3-7-17(11-14)25-21(27)20-12-19-18(8-9-24-22(19)28-20)15-5-2-6-16(23)10-15/h2-11,20H,12H2,1H3,(H,25,27).
What are the key properties of N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide has a molecular weight of 376.39 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 46942698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).