(8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone

C15H15ClN2O2 — CID 53016164

IUPAC(8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone
SMILESCc1cc(C(=O)N2CCOCC2)c2cccc(Cl)c2n1
InChIInChI=1S/C15H15ClN2O2/c1-10-9-12(15(19)18-5-7-20-8-6-18)11-3-2-4-13(16)14(11)17-10/h2-4,9H,5-8H2,1H3
InChIKeyLIIWOYKREVKQHF-UHFFFAOYSA-N
MW290.75 g/mol
LogP2.67
Rot. Bonds1

About (8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone

(8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone (PubChem CID 53016164) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is (8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone
PubChem CID53016164
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name(8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone
SMILESCc1cc(C(=O)N2CCOCC2)c2cccc(Cl)c2n1
InChIInChI=1S/C15H15ClN2O2/c1-10-9-12(15(19)18-5-7-20-8-6-18)11-3-2-4-13(16)14(11)17-10/h2-4,9H,5-8H2,1H3
InChIKeyLIIWOYKREVKQHF-UHFFFAOYSA-N
XLogP2.67
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone?
The IUPAC name of (8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone (CID 53016164) is (8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone is Cc1cc(C(=O)N2CCOCC2)c2cccc(Cl)c2n1.
What is the InChIKey of (8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone?
The InChIKey is LIIWOYKREVKQHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10-9-12(15(19)18-5-7-20-8-6-18)11-3-2-4-13(16)14(11)17-10/h2-4,9H,5-8H2,1H3.
What are the key properties of (8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone?
(8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone has a molecular weight of 290.75 g/mol, XLogP of 2.67, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-chloro-2-methylquinolin-4-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 53016164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).