1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone

C19H24N4O2 — CID 75370496

IUPAC1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone
SMILESO=C(CN1CCN(c2ccnc3ccccc23)CC1)N1CCOCC1
InChIInChI=1S/C19H24N4O2/c24-19(23-11-13-25-14-12-23)15-21-7-9-22(10-8-21)18-5-6-20-17-4-2-1-3-16(17)18/h1-6H,7-15H2
InChIKeyBAJLUWNSZNQCBA-UHFFFAOYSA-N
MW340.43 g/mol
LogP1.22
Rot. Bonds3

About 1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone

1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone (PubChem CID 75370496) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone
PubChem CID75370496
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone
SMILESO=C(CN1CCN(c2ccnc3ccccc23)CC1)N1CCOCC1
InChIInChI=1S/C19H24N4O2/c24-19(23-11-13-25-14-12-23)15-21-7-9-22(10-8-21)18-5-6-20-17-4-2-1-3-16(17)18/h1-6H,7-15H2
InChIKeyBAJLUWNSZNQCBA-UHFFFAOYSA-N
XLogP1.22
TPSA48.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone?
The IUPAC name of 1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone (CID 75370496) is 1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone?
The canonical SMILES for 1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone is O=C(CN1CCN(c2ccnc3ccccc23)CC1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone?
The InChIKey is BAJLUWNSZNQCBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c24-19(23-11-13-25-14-12-23)15-21-7-9-22(10-8-21)18-5-6-20-17-4-2-1-3-16(17)18/h1-6H,7-15H2.
What are the key properties of 1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone?
1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone has a molecular weight of 340.43 g/mol, XLogP of 1.22, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-(4-quinolin-4-ylpiperazin-1-yl)ethanone is sourced from PubChem (CID 75370496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).