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

C25H25N3O4 — CID 110251818

IUPAC[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone
SMILESO=C(c1ccccc1)N1CCOC(c2cc(C(=O)N3CCOCC3)c3ccccc3n2)C1
InChIInChI=1S/C25H25N3O4/c29-24(18-6-2-1-3-7-18)28-12-15-32-23(17-28)22-16-20(19-8-4-5-9-21(19)26-22)25(30)27-10-13-31-14-11-27/h1-9,16,23H,10-15,17H2
InChIKeyKRQWJFVRAQAYFF-UHFFFAOYSA-N
MW431.49 g/mol
LogP2.92
Rot. Bonds3

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

[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone (PubChem CID 110251818) has the molecular formula C25H25N3O4 and a molecular weight of 431.49 g/mol. Its IUPAC name is [2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone.

Molecular Properties

Compound Name[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone
PubChem CID110251818
Molecular FormulaC25H25N3O4
Molecular Weight431.49 g/mol
Exact Mass431.18
IUPAC Name[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone
SMILESO=C(c1ccccc1)N1CCOC(c2cc(C(=O)N3CCOCC3)c3ccccc3n2)C1
InChIInChI=1S/C25H25N3O4/c29-24(18-6-2-1-3-7-18)28-12-15-32-23(17-28)22-16-20(19-8-4-5-9-21(19)26-22)25(30)27-10-13-31-14-11-27/h1-9,16,23H,10-15,17H2
InChIKeyKRQWJFVRAQAYFF-UHFFFAOYSA-N
XLogP2.92
TPSA71.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.49
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone
CID 110251795
[(2S)-2-[4-(4-methylpiperazine-1-carbonyl)quinolin-2-yl]morpholin-4-yl]-pyridin-4-ylmethanone
CID 92638221
morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone
CID 92639103
2-[(2R)-4-benzoylmorpholin-2-yl]-N-(2-methylpropyl)quinoline-4-carboxamide
CID 92638905
morpholin-4-yl-(2-morpholin-2-ylquinolin-4-yl)methanone
CID 110089333
2-[(2S)-4-(pyridine-3-carbonyl)morpholin-2-yl]quinoline-4-carboxamide
CID 92638264
[(2R)-2-[4-(4-methylpiperazine-1-carbonyl)quinolin-2-yl]morpholin-4-yl]-pyridin-2-ylmethanone
CID 92639213
N-propan-2-yl-2-[(2S)-4-(pyridine-4-carbonyl)morpholin-2-yl]quinoline-4-carboxamide
CID 92638218
[2-[4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]quinolin-4-yl]-morpholin-4-ylmethanone
CID 110251874
[2-[(2S)-4-[(3-methoxyphenyl)methyl]morpholin-2-yl]quinolin-4-yl]-morpholin-4-ylmethanone
CID 92638405
N-(2-methoxyethyl)-2-[(2S)-4-(pyridine-4-carbonyl)morpholin-2-yl]quinoline-4-carboxamide
CID 92636667
N-propan-2-yl-2-[(2S)-4-(pyridine-3-carbonyl)morpholin-2-yl]quinoline-4-carboxamide
CID 95815271

Frequently Asked Questions

What is the IUPAC name of [2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone?
The IUPAC name of [2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone (CID 110251818) is [2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone.
What is the SMILES notation for [2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone?
The canonical SMILES for [2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone is O=C(c1ccccc1)N1CCOC(c2cc(C(=O)N3CCOCC3)c3ccccc3n2)C1.
What is the InChIKey of [2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone?
The InChIKey is KRQWJFVRAQAYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O4/c29-24(18-6-2-1-3-7-18)28-12-15-32-23(17-28)22-16-20(19-8-4-5-9-21(19)26-22)25(30)27-10-13-31-14-11-27/h1-9,16,23H,10-15,17H2.
What are the key properties of [2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone?
[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone has a molecular weight of 431.49 g/mol, XLogP of 2.92, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone is sourced from PubChem (CID 110251818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).