methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate

C24H19N3O4 — CID 147687173

IUPACmethyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate
SMILESCOC(=O)c1cc2c(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)ccnc2o1
InChIInChI=1S/C24H19N3O4/c1-30-24(29)21-12-20-19(8-9-26-23(20)31-21)17-11-16(13-25-14-17)15-4-6-18(7-5-15)27-10-2-3-22(27)28/h4-9,11-14H,2-3,10H2,1H3
InChIKeyGQGKGKMATFHHRD-UHFFFAOYSA-N
MW413.43 g/mol
LogP4.47
Rot. Bonds4

About methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate

methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate (PubChem CID 147687173) has the molecular formula C24H19N3O4 and a molecular weight of 413.43 g/mol. Its IUPAC name is methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate.

Molecular Properties

Compound Namemethyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate
PubChem CID147687173
Molecular FormulaC24H19N3O4
Molecular Weight413.43 g/mol
Exact Mass413.14
IUPAC Namemethyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate
SMILESCOC(=O)c1cc2c(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)ccnc2o1
InChIInChI=1S/C24H19N3O4/c1-30-24(29)21-12-20-19(8-9-26-23(20)31-21)17-11-16(13-25-14-17)15-4-6-18(7-5-15)27-10-2-3-22(27)28/h4-9,11-14H,2-3,10H2,1H3
InChIKeyGQGKGKMATFHHRD-UHFFFAOYSA-N
XLogP4.47
TPSA85.53 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.43
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate with MolForge

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Related Compounds

N-(2-methoxyethyl)-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxamide
CID 151383060
methyl 4-[5-[2-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
CID 147012999
1-[4-[2-amino-5-[2-[2-(oxetan-3-yl)acetyl]furo[2,3-b]pyridin-4-yl]-3-pyridinyl]phenyl]pyrrolidin-2-one
CID 159139332
4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-N-phenyl-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 149271340
1-[4-[5-(1,3-dimethylpyrrolo[2,3-b]pyridin-4-yl)-3-pyridinyl]phenyl]pyrrolidin-2-one
CID 155227317
N,N-dimethyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-7H-cyclopenta[b]pyridine-6-carboxamide
CID 162257714
1-[4-[5-[6-(pyrrolidine-1-carbonyl)-7H-cyclopenta[b]pyridin-4-yl]-3-pyridinyl]phenyl]pyrrolidin-2-one
CID 159588070
4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]-N-pyridin-4-yl-7H-cyclopenta[b]pyridine-6-carboxamide
CID 158497159
N,1-dimethyl-3-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]pyrrolo[2,3-b]pyridine-5-carboxamide
CID 147144985
1-[3-methyl-4-(5-pyridin-4-yl-3-pyridinyl)phenyl]pyrrolidin-2-one
CID 146702656
1-[4-[5-[2-(3-cyclopropyl-3-hydroxypiperidine-1-carbonyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]-3-pyridinyl]phenyl]pyrrolidin-2-one
CID 155210730
1-methyl-4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]pyridin-2-one
CID 155210706

Frequently Asked Questions

What is the IUPAC name of methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate?
The IUPAC name of methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate (CID 147687173) is methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate.
What is the SMILES notation for methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate?
The canonical SMILES for methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate is COC(=O)c1cc2c(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)ccnc2o1.
What is the InChIKey of methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate?
The InChIKey is GQGKGKMATFHHRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O4/c1-30-24(29)21-12-20-19(8-9-26-23(20)31-21)17-11-16(13-25-14-17)15-4-6-18(7-5-15)27-10-2-3-22(27)28/h4-9,11-14H,2-3,10H2,1H3.
What are the key properties of methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate?
methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate has a molecular weight of 413.43 g/mol, XLogP of 4.47, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[5-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-pyridinyl]furo[2,3-b]pyridine-2-carboxylate is sourced from PubChem (CID 147687173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).