2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone

C16H16Cl2N2O3 — CID 2707767

IUPAC2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone
SMILESCc1ccc2c(Cl)cc(Cl)c(OCC(=O)N3CCOCC3)c2n1
InChIInChI=1S/C16H16Cl2N2O3/c1-10-2-3-11-12(17)8-13(18)16(15(11)19-10)23-9-14(21)20-4-6-22-7-5-20/h2-3,8H,4-7,9H2,1H3
InChIKeyHLPRXAUHUHVQAB-UHFFFAOYSA-N
MW355.22 g/mol
LogP3.09
Rot. Bonds3

About 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone

2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone (PubChem CID 2707767) has the molecular formula C16H16Cl2N2O3 and a molecular weight of 355.22 g/mol. Its IUPAC name is 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone
PubChem CID2707767
Molecular FormulaC16H16Cl2N2O3
Molecular Weight355.22 g/mol
Exact Mass354.05
IUPAC Name2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone
SMILESCc1ccc2c(Cl)cc(Cl)c(OCC(=O)N3CCOCC3)c2n1
InChIInChI=1S/C16H16Cl2N2O3/c1-10-2-3-11-12(17)8-13(18)16(15(11)19-10)23-9-14(21)20-4-6-22-7-5-20/h2-3,8H,4-7,9H2,1H3
InChIKeyHLPRXAUHUHVQAB-UHFFFAOYSA-N
XLogP3.09
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.22
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone?
The IUPAC name of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone (CID 2707767) is 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone is Cc1ccc2c(Cl)cc(Cl)c(OCC(=O)N3CCOCC3)c2n1.
What is the InChIKey of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone?
The InChIKey is HLPRXAUHUHVQAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O3/c1-10-2-3-11-12(17)8-13(18)16(15(11)19-10)23-9-14(21)20-4-6-22-7-5-20/h2-3,8H,4-7,9H2,1H3.
What are the key properties of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone?
2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone has a molecular weight of 355.22 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-1-morpholin-4-ylethanone is sourced from PubChem (CID 2707767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).