1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone

C20H23N3O4 — CID 110251795

IUPAC1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone
SMILESCC(=O)N1CCOC(c2cc(C(=O)N3CCOCC3)c3ccccc3n2)C1
InChIInChI=1S/C20H23N3O4/c1-14(24)23-8-11-27-19(13-23)18-12-16(15-4-2-3-5-17(15)21-18)20(25)22-6-9-26-10-7-22/h2-5,12,19H,6-11,13H2,1H3
InChIKeyJKOKKRPCGJOIGQ-UHFFFAOYSA-N
MW369.42 g/mol
LogP1.63
Rot. Bonds2

About 1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone

1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone (PubChem CID 110251795) has the molecular formula C20H23N3O4 and a molecular weight of 369.42 g/mol. Its IUPAC name is 1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone.

Molecular Properties

Compound Name1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone
PubChem CID110251795
Molecular FormulaC20H23N3O4
Molecular Weight369.42 g/mol
Exact Mass369.17
IUPAC Name1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone
SMILESCC(=O)N1CCOC(c2cc(C(=O)N3CCOCC3)c3ccccc3n2)C1
InChIInChI=1S/C20H23N3O4/c1-14(24)23-8-11-27-19(13-23)18-12-16(15-4-2-3-5-17(15)21-18)20(25)22-6-9-26-10-7-22/h2-5,12,19H,6-11,13H2,1H3
InChIKeyJKOKKRPCGJOIGQ-UHFFFAOYSA-N
XLogP1.63
TPSA71.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone?
The IUPAC name of 1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone (CID 110251795) is 1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone.
What is the SMILES notation for 1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone?
The canonical SMILES for 1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone is CC(=O)N1CCOC(c2cc(C(=O)N3CCOCC3)c3ccccc3n2)C1.
What is the InChIKey of 1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone?
The InChIKey is JKOKKRPCGJOIGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O4/c1-14(24)23-8-11-27-19(13-23)18-12-16(15-4-2-3-5-17(15)21-18)20(25)22-6-9-26-10-7-22/h2-5,12,19H,6-11,13H2,1H3.
What are the key properties of 1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone?
1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone has a molecular weight of 369.42 g/mol, XLogP of 1.63, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone is sourced from PubChem (CID 110251795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).