(2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone

C19H24N2O2 — CID 1166452

IUPAC(2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone
SMILESCCc1nc2c(C)cc(C)cc2c(C(=O)N2CCOCC2)c1C
InChIInChI=1S/C19H24N2O2/c1-5-16-14(4)17(19(22)21-6-8-23-9-7-21)15-11-12(2)10-13(3)18(15)20-16/h10-11H,5-9H2,1-4H3
InChIKeyWUGYHZWPAGRPPP-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.19
Rot. Bonds2

About (2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone

(2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone (PubChem CID 1166452) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is (2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone
PubChem CID1166452
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name(2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone
SMILESCCc1nc2c(C)cc(C)cc2c(C(=O)N2CCOCC2)c1C
InChIInChI=1S/C19H24N2O2/c1-5-16-14(4)17(19(22)21-6-8-23-9-7-21)15-11-12(2)10-13(3)18(15)20-16/h10-11H,5-9H2,1-4H3
InChIKeyWUGYHZWPAGRPPP-UHFFFAOYSA-N
XLogP3.19
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone?
The IUPAC name of (2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone (CID 1166452) is (2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone is CCc1nc2c(C)cc(C)cc2c(C(=O)N2CCOCC2)c1C.
What is the InChIKey of (2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone?
The InChIKey is WUGYHZWPAGRPPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-5-16-14(4)17(19(22)21-6-8-23-9-7-21)15-11-12(2)10-13(3)18(15)20-16/h10-11H,5-9H2,1-4H3.
What are the key properties of (2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone?
(2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone has a molecular weight of 312.41 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-3,6,8-trimethylquinolin-4-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 1166452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).