4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide

C22H18N2O4 — CID 46943993

IUPAC4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESO=C(NCc1ccccc1)C1Cc2c(-c3ccc4c(c3)OCO4)ccnc2O1
InChIInChI=1S/C22H18N2O4/c25-21(24-12-14-4-2-1-3-5-14)20-11-17-16(8-9-23-22(17)28-20)15-6-7-18-19(10-15)27-13-26-18/h1-10,20H,11-13H2,(H,24,25)
InChIKeyYYPJHVRXMYURIX-UHFFFAOYSA-N
MW374.40 g/mol
LogP3.10
Rot. Bonds4

About 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide

4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (PubChem CID 46943993) has the molecular formula C22H18N2O4 and a molecular weight of 374.40 g/mol. Its IUPAC name is 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
PubChem CID46943993
Molecular FormulaC22H18N2O4
Molecular Weight374.40 g/mol
Exact Mass374.13
IUPAC Name4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESO=C(NCc1ccccc1)C1Cc2c(-c3ccc4c(c3)OCO4)ccnc2O1
InChIInChI=1S/C22H18N2O4/c25-21(24-12-14-4-2-1-3-5-14)20-11-17-16(8-9-23-22(17)28-20)15-6-7-18-19(10-15)27-13-26-18/h1-10,20H,11-13H2,(H,24,25)
InChIKeyYYPJHVRXMYURIX-UHFFFAOYSA-N
XLogP3.10
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (CID 46943993) is 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is O=C(NCc1ccccc1)C1Cc2c(-c3ccc4c(c3)OCO4)ccnc2O1.
What is the InChIKey of 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The InChIKey is YYPJHVRXMYURIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O4/c25-21(24-12-14-4-2-1-3-5-14)20-11-17-16(8-9-23-22(17)28-20)15-6-7-18-19(10-15)27-13-26-18/h1-10,20H,11-13H2,(H,24,25).
What are the key properties of 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide has a molecular weight of 374.40 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-benzodioxol-5-yl)-N-benzyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 46943993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).