1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine

C22H26N2O3 — CID 57439372

IUPAC1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine
SMILESc1cc2c(cc1OCCN1CCC1)oc1cc(OCCN3CCC3)ccc12
InChIInChI=1S/C22H26N2O3/c1-7-23(8-1)11-13-25-17-3-5-19-20-6-4-18(16-22(20)27-21(19)15-17)26-14-12-24-9-2-10-24/h3-6,15-16H,1-2,7-14H2
InChIKeyXFQDAKFCCHGFGU-UHFFFAOYSA-N
MW366.46 g/mol
LogP3.76
Rot. Bonds8

About 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine

1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine (PubChem CID 57439372) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine.

Molecular Properties

Compound Name1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine
PubChem CID57439372
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC Name1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine
SMILESc1cc2c(cc1OCCN1CCC1)oc1cc(OCCN3CCC3)ccc12
InChIInChI=1S/C22H26N2O3/c1-7-23(8-1)11-13-25-17-3-5-19-20-6-4-18(16-22(20)27-21(19)15-17)26-14-12-24-9-2-10-24/h3-6,15-16H,1-2,7-14H2
InChIKeyXFQDAKFCCHGFGU-UHFFFAOYSA-N
XLogP3.76
TPSA38.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine 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

1-[3-[7-[3-(azetidin-1-yl)propoxy]dibenzofuran-2-yl]oxypropyl]azetidine
CID 57439391
1,6-bis(2-piperidin-1-ylethoxy)xanthen-9-one
CID 54365368
2,6-bis(3-piperidin-1-ylpropoxy)xanthen-9-one
CID 57439571
3-phenyl-7-(2-piperidin-1-ylethoxy)-4-[4-(2-piperidin-1-ylethoxy)phenyl]chromen-2-one
CID 71817959
7-(2-morpholin-4-ylethoxy)-2-phenylchromen-4-one
CID 162359717
4-(4-hydroxyphenyl)-3-phenyl-7-(2-piperidin-1-ylethoxy)chromen-2-one
CID 71818110
2-[2-hydroxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-6-methoxy-1-benzofuran-3-carboxylic acid
CID 141398778
3,8-bis[2-(azetidin-1-yl)ethoxy]-5H-phenanthridin-6-one
CID 57439766
1-[2-[7-(2-pyrrolidin-1-ylethoxy)dibenzothiophen-2-yl]oxyethyl]pyrrolidine
CID 67163021
N-methyl-3-[7-[3-(methylamino)propoxy]dibenzofuran-3-yl]oxypropan-1-amine
CID 57439364
2,6-bis[2-(azetidin-1-yl)ethoxy]-10H-acridin-9-one
CID 11406725
1-[2-(3,4-dimethylphenoxy)ethyl]azepane
CID 82086608

Frequently Asked Questions

What is the IUPAC name of 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine?
The IUPAC name of 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine (CID 57439372) is 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine.
What is the SMILES notation for 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine?
The canonical SMILES for 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine is c1cc2c(cc1OCCN1CCC1)oc1cc(OCCN3CCC3)ccc12.
What is the InChIKey of 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine?
The InChIKey is XFQDAKFCCHGFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-7-23(8-1)11-13-25-17-3-5-19-20-6-4-18(16-22(20)27-21(19)15-17)26-14-12-24-9-2-10-24/h3-6,15-16H,1-2,7-14H2.
What are the key properties of 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine?
1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine has a molecular weight of 366.46 g/mol, XLogP of 3.76, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[7-[2-(azetidin-1-yl)ethoxy]dibenzofuran-3-yl]oxyethyl]azetidine is sourced from PubChem (CID 57439372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).