(2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone

C22H22N2O3 — CID 70774437

IUPAC(2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone
SMILESCOc1ccccc1OC1CN(C(=O)c2ccc3c(C)cc(C)nc3c2)C1
InChIInChI=1S/C22H22N2O3/c1-14-10-15(2)23-19-11-16(8-9-18(14)19)22(25)24-12-17(13-24)27-21-7-5-4-6-20(21)26-3/h4-11,17H,12-13H2,1-3H3
InChIKeyPSLCVNZTAZKUDQ-UHFFFAOYSA-N
MW362.43 g/mol
LogP3.76
Rot. Bonds4

About (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone

(2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone (PubChem CID 70774437) has the molecular formula C22H22N2O3 and a molecular weight of 362.43 g/mol. Its IUPAC name is (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone.

Molecular Properties

Compound Name(2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone
PubChem CID70774437
Molecular FormulaC22H22N2O3
Molecular Weight362.43 g/mol
Exact Mass362.16
IUPAC Name(2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone
SMILESCOc1ccccc1OC1CN(C(=O)c2ccc3c(C)cc(C)nc3c2)C1
InChIInChI=1S/C22H22N2O3/c1-14-10-15(2)23-19-11-16(8-9-18(14)19)22(25)24-12-17(13-24)27-21-7-5-4-6-20(21)26-3/h4-11,17H,12-13H2,1-3H3
InChIKeyPSLCVNZTAZKUDQ-UHFFFAOYSA-N
XLogP3.76
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone 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 (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone?
The IUPAC name of (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone (CID 70774437) is (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone.
What is the SMILES notation for (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone?
The canonical SMILES for (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone is COc1ccccc1OC1CN(C(=O)c2ccc3c(C)cc(C)nc3c2)C1.
What is the InChIKey of (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone?
The InChIKey is PSLCVNZTAZKUDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O3/c1-14-10-15(2)23-19-11-16(8-9-18(14)19)22(25)24-12-17(13-24)27-21-7-5-4-6-20(21)26-3/h4-11,17H,12-13H2,1-3H3.
What are the key properties of (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone?
(2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone has a molecular weight of 362.43 g/mol, XLogP of 3.76, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylquinolin-7-yl)-[3-(2-methoxyphenoxy)azetidin-1-yl]methanone is sourced from PubChem (CID 70774437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).