2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine

C18H20N2O3 — CID 153303687

IUPAC2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccc2c(n1)oc1c(N3OC(C)(C)C(C)(C)O3)cccc12
InChIInChI=1S/C18H20N2O3/c1-11-9-10-13-12-7-6-8-14(15(12)21-16(13)19-11)20-22-17(2,3)18(4,5)23-20/h6-10H,1-5H3
InChIKeyBWNUCPBFBHJCQF-UHFFFAOYSA-N
MW312.37 g/mol
LogP4.53
Rot. Bonds1

About 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine

2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine (PubChem CID 153303687) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine.

Molecular Properties

Compound Name2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine
PubChem CID153303687
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccc2c(n1)oc1c(N3OC(C)(C)C(C)(C)O3)cccc12
InChIInChI=1S/C18H20N2O3/c1-11-9-10-13-12-7-6-8-14(15(12)21-16(13)19-11)20-22-17(2,3)18(4,5)23-20/h6-10H,1-5H3
InChIKeyBWNUCPBFBHJCQF-UHFFFAOYSA-N
XLogP4.53
TPSA47.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine with MolForge

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

Launch Full Analysis

Related Compounds

2-methyl-8-[3-[4-[3-(2-methyl-[1]benzofuro[2,3-b]pyridin-8-yl)-2H-imidazol-1-yl]butyl]-2H-imidazol-1-yl]-[1]benzofuro[2,3-b]pyridine
CID 155607566
2-methyl-8-(2-methyl-3-propan-2-yl-2H-benzimidazol-1-yl)-[1]benzofuro[2,3-b]pyridine
CID 170184357
8-[(2S)-3-ethyl-2-methyl-2H-imidazol-1-yl]-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 118085549
2-methyl-8-[2-(2-methylpropyl)imidazol-1-yl]-[1]benzofuro[2,3-b]pyridine
CID 135243113
8-(2,3-dimethylthieno[2,3-b]pyridin-6-yl)-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 168828426
2-methyl-8-(5,5,8,8-tetramethyl-6,7-dihydro-[1]benzothiolo[2,3-b]pyridin-2-yl)-[1]benzofuro[2,3-b]pyridine
CID 168828621
[6-(2-methyl-[1]benzofuro[2,3-b]pyridin-8-yl)-2-pyridinyl]-phenyl-(6-phenyl-2-pyridinyl)borane
CID 140742144
2-methyl-8-thieno[3,2-b]pyridin-5-yl-[1]benzofuro[2,3-b]pyridine
CID 168828175
2-methyl-8-pyridin-2-yl-[1]benzofuro[2,3-b]pyridin-7-amine
CID 176956277
2-methyl-8-[6-[(6-pyrazol-1-yl-2-pyridinyl)oxy]-2-pyridinyl]-[1]benzofuro[2,3-b]pyridine
CID 140741868
2-methyl-8-[6-(1,3-thiazol-2-yl)-2-pyridinyl]-[1]benzofuro[2,3-b]pyridine
CID 170401926
8-(2,10-dimethylbenzo[h]quinazolin-4-yl)-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 162692686

Frequently Asked Questions

What is the IUPAC name of 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine?
The IUPAC name of 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine (CID 153303687) is 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine.
What is the SMILES notation for 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine?
The canonical SMILES for 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine is Cc1ccc2c(n1)oc1c(N3OC(C)(C)C(C)(C)O3)cccc12.
What is the InChIKey of 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine?
The InChIKey is BWNUCPBFBHJCQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-11-9-10-13-12-7-6-8-14(15(12)21-16(13)19-11)20-22-17(2,3)18(4,5)23-20/h6-10H,1-5H3.
What are the key properties of 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine?
2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine has a molecular weight of 312.37 g/mol, XLogP of 4.53, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)-[1]benzofuro[2,3-b]pyridine is sourced from PubChem (CID 153303687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).