4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine

C18H24N2O3 — CID 145139266

IUPAC4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine
SMILESCc1ccc2ccc(OCCOCCN3CCOCC3)cc2n1
InChIInChI=1S/C18H24N2O3/c1-15-2-3-16-4-5-17(14-18(16)19-15)23-13-12-22-11-8-20-6-9-21-10-7-20/h2-5,14H,6-13H2,1H3
InChIKeyJTNUWGBXQIOZGU-UHFFFAOYSA-N
MW316.40 g/mol
LogP2.27
Rot. Bonds7

About 4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine

4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine (PubChem CID 145139266) has the molecular formula C18H24N2O3 and a molecular weight of 316.40 g/mol. Its IUPAC name is 4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine
PubChem CID145139266
Molecular FormulaC18H24N2O3
Molecular Weight316.40 g/mol
Exact Mass316.18
IUPAC Name4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine
SMILESCc1ccc2ccc(OCCOCCN3CCOCC3)cc2n1
InChIInChI=1S/C18H24N2O3/c1-15-2-3-16-4-5-17(14-18(16)19-15)23-13-12-22-11-8-20-6-9-21-10-7-20/h2-5,14H,6-13H2,1H3
InChIKeyJTNUWGBXQIOZGU-UHFFFAOYSA-N
XLogP2.27
TPSA43.82 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine?
The IUPAC name of 4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine (CID 145139266) is 4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine.
What is the SMILES notation for 4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine?
The canonical SMILES for 4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine is Cc1ccc2ccc(OCCOCCN3CCOCC3)cc2n1.
What is the InChIKey of 4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine?
The InChIKey is JTNUWGBXQIOZGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3/c1-15-2-3-16-4-5-17(14-18(16)19-15)23-13-12-22-11-8-20-6-9-21-10-7-20/h2-5,14H,6-13H2,1H3.
What are the key properties of 4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine?
4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine has a molecular weight of 316.40 g/mol, XLogP of 2.27, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[2-(2-methylquinolin-7-yl)oxyethoxy]ethyl]morpholine is sourced from PubChem (CID 145139266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).