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

C21H18FN3O4S — CID 46948266

IUPAC4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESCS(=O)(=O)Nc1cccc(NC(=O)C2Cc3c(-c4cccc(F)c4)ccnc3O2)c1
InChIInChI=1S/C21H18FN3O4S/c1-30(27,28)25-16-7-3-6-15(11-16)24-20(26)19-12-18-17(8-9-23-21(18)29-19)13-4-2-5-14(22)10-13/h2-11,19,25H,12H2,1H3,(H,24,26)
InChIKeyALBSGVOHARNNSV-UHFFFAOYSA-N
MW427.46 g/mol
LogP3.20
Rot. Bonds5

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

4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (PubChem CID 46948266) has the molecular formula C21H18FN3O4S and a molecular weight of 427.46 g/mol. Its IUPAC name is 4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
PubChem CID46948266
Molecular FormulaC21H18FN3O4S
Molecular Weight427.46 g/mol
Exact Mass427.10
IUPAC Name4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESCS(=O)(=O)Nc1cccc(NC(=O)C2Cc3c(-c4cccc(F)c4)ccnc3O2)c1
InChIInChI=1S/C21H18FN3O4S/c1-30(27,28)25-16-7-3-6-15(11-16)24-20(26)19-12-18-17(8-9-23-21(18)29-19)13-4-2-5-14(22)10-13/h2-11,19,25H,12H2,1H3,(H,24,26)
InChIKeyALBSGVOHARNNSV-UHFFFAOYSA-N
XLogP3.20
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.46
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide with MolForge

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Related Compounds

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
2-methyl-N-(oxan-4-ylmethyl)-4-[3-(trifluoromethyl)phenyl]-3H-furo[2,3-b]pyridine-2-carboxamide
CID 46942721
4-(3-acetamidophenyl)-N-benzyl-2-methyl-3H-furo[2,3-b]pyridine-2-carboxamide
CID 46943732
N-[[4-(dimethylamino)phenyl]methyl]-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide
CID 46943954
4-(3-fluorophenyl)-N-methyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
CID 46944191
N-benzyl-4-(3-fluorophenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
CID 49778387
4-(4-acetamidophenyl)-N-(2-methoxyethyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
CID 49778583
4-(2-phenoxyphenyl)-N-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
CID 49778707
4-(3-carbamoylphenyl)-2-methyl-N-(4-propan-2-ylphenyl)-3H-furo[2,3-b]pyridine-2-carboxamide
CID 49778877
4-(4-acetamidophenyl)-2-methyl-N-[3-(trifluoromethoxy)phenyl]-3H-furo[2,3-b]pyridine-2-carboxamide
CID 49786305
4-(3-acetylphenyl)-N-(4-methoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
CID 49786753

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (CID 46948266) is 4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is CS(=O)(=O)Nc1cccc(NC(=O)C2Cc3c(-c4cccc(F)c4)ccnc3O2)c1.
What is the InChIKey of 4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The InChIKey is ALBSGVOHARNNSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FN3O4S/c1-30(27,28)25-16-7-3-6-15(11-16)24-20(26)19-12-18-17(8-9-23-21(18)29-19)13-4-2-5-14(22)10-13/h2-11,19,25H,12H2,1H3,(H,24,26).
What are the key properties of 4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide has a molecular weight of 427.46 g/mol, XLogP of 3.20, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenyl)-N-[3-(methanesulfonamido)phenyl]-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 46948266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).