bis(2-morpholin-4-ylquinoxalin-6-yl)methanone

C25H24N6O3 — CID 151491691

IUPACbis(2-morpholin-4-ylquinoxalin-6-yl)methanone
SMILESO=C(c1ccc2nc(N3CCOCC3)cnc2c1)c1ccc2nc(N3CCOCC3)cnc2c1
InChIInChI=1S/C25H24N6O3/c32-25(17-1-3-19-21(13-17)26-15-23(28-19)30-5-9-33-10-6-30)18-2-4-20-22(14-18)27-16-24(29-20)31-7-11-34-12-8-31/h1-4,13-16H,5-12H2
InChIKeyPOPCTPNVALRSGX-UHFFFAOYSA-N
MW456.51 g/mol
LogP2.48
Rot. Bonds4

About bis(2-morpholin-4-ylquinoxalin-6-yl)methanone

bis(2-morpholin-4-ylquinoxalin-6-yl)methanone (PubChem CID 151491691) has the molecular formula C25H24N6O3 and a molecular weight of 456.51 g/mol. Its IUPAC name is bis(2-morpholin-4-ylquinoxalin-6-yl)methanone.

Molecular Properties

Compound Namebis(2-morpholin-4-ylquinoxalin-6-yl)methanone
PubChem CID151491691
Molecular FormulaC25H24N6O3
Molecular Weight456.51 g/mol
Exact Mass456.19
IUPAC Namebis(2-morpholin-4-ylquinoxalin-6-yl)methanone
SMILESO=C(c1ccc2nc(N3CCOCC3)cnc2c1)c1ccc2nc(N3CCOCC3)cnc2c1
InChIInChI=1S/C25H24N6O3/c32-25(17-1-3-19-21(13-17)26-15-23(28-19)30-5-9-33-10-6-30)18-2-4-20-22(14-18)27-16-24(29-20)31-7-11-34-12-8-31/h1-4,13-16H,5-12H2
InChIKeyPOPCTPNVALRSGX-UHFFFAOYSA-N
XLogP2.48
TPSA93.57 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.51
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Related Compounds

(2-fluoro-5-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone
CID 89478345
(2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone
CID 89478019
4-(3-morpholin-4-ylquinoxalin-6-yl)benzamide
CID 67036137
1-[3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 71532895
(E)-2-(3-morpholin-4-ylquinoxalin-6-yl)prop-1-en-1-amine
CID 143761172
N-[3,4-difluoro-5-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]propane-1-sulfonamide
CID 71268676
4-chloro-3-fluoro-N-[3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]benzamide
CID 89445010
N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide
CID 71538187
1-[4-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 90134872
N-[4-chloro-2-fluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]-3,4-difluorobenzamide
CID 89445006
3-chloro-N-[3,4-difluoro-5-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]-4-fluorobenzamide
CID 89445214
4-[7-[2,3-difluoro-5-[3-(sulfinoamino)propyl]benzoyl]quinoxalin-2-yl]morpholine
CID 71282402

Frequently Asked Questions

What is the IUPAC name of bis(2-morpholin-4-ylquinoxalin-6-yl)methanone?
The IUPAC name of bis(2-morpholin-4-ylquinoxalin-6-yl)methanone (CID 151491691) is bis(2-morpholin-4-ylquinoxalin-6-yl)methanone.
What is the SMILES notation for bis(2-morpholin-4-ylquinoxalin-6-yl)methanone?
The canonical SMILES for bis(2-morpholin-4-ylquinoxalin-6-yl)methanone is O=C(c1ccc2nc(N3CCOCC3)cnc2c1)c1ccc2nc(N3CCOCC3)cnc2c1.
What is the InChIKey of bis(2-morpholin-4-ylquinoxalin-6-yl)methanone?
The InChIKey is POPCTPNVALRSGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6O3/c32-25(17-1-3-19-21(13-17)26-15-23(28-19)30-5-9-33-10-6-30)18-2-4-20-22(14-18)27-16-24(29-20)31-7-11-34-12-8-31/h1-4,13-16H,5-12H2.
What are the key properties of bis(2-morpholin-4-ylquinoxalin-6-yl)methanone?
bis(2-morpholin-4-ylquinoxalin-6-yl)methanone has a molecular weight of 456.51 g/mol, XLogP of 2.48, 4 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-morpholin-4-ylquinoxalin-6-yl)methanone is sourced from PubChem (CID 151491691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).