1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one

C24H25N3O2 — CID 158380673

IUPAC1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one
SMILESO=C(Cc1ccc(-c2ccc3ncc(N4CCOCC4)nc3c2)cc1)CC1CC1
InChIInChI=1S/C24H25N3O2/c28-21(13-17-1-2-17)14-18-3-5-19(6-4-18)20-7-8-22-23(15-20)26-24(16-25-22)27-9-11-29-12-10-27/h3-8,15-17H,1-2,9-14H2
InChIKeyGVTARWNJTPEOMO-UHFFFAOYSA-N
MW387.48 g/mol
LogP4.05
Rot. Bonds6

About 1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one

1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one (PubChem CID 158380673) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is 1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one
PubChem CID158380673
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC Name1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one
SMILESO=C(Cc1ccc(-c2ccc3ncc(N4CCOCC4)nc3c2)cc1)CC1CC1
InChIInChI=1S/C24H25N3O2/c28-21(13-17-1-2-17)14-18-3-5-19(6-4-18)20-7-8-22-23(15-20)26-24(16-25-22)27-9-11-29-12-10-27/h3-8,15-17H,1-2,9-14H2
InChIKeyGVTARWNJTPEOMO-UHFFFAOYSA-N
XLogP4.05
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclohexyl-2-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]ethanone
CID 159328346
1-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]-3-[4-(trifluoromethyl)phenyl]propan-2-one
CID 153102403
2-cyclopropyl-1-[3-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]ethanone
CID 147372579
4-(3-morpholin-4-ylquinoxalin-6-yl)benzamide
CID 67036137
1-[3-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]-2-phenylethanone
CID 157427262
2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide
CID 67035546
1-pyridin-3-yl-3-[4-[3-(4-pyridin-4-ylpiperazin-1-yl)quinoxalin-6-yl]phenyl]propan-2-one
CID 152895241
4-[7-(3,5-difluorophenyl)quinoxalin-2-yl]morpholine
CID 67035153
1-[4-(3-morpholin-4-ylquinoxalin-6-yl)oxyphenyl]-3-[4-(trifluoromethyl)phenyl]propan-2-one
CID 149259043
1-[4-(dimethylamino)phenyl]-3-[4-[3-(4-pyridin-4-ylpiperazin-1-yl)quinoxalin-6-yl]phenyl]propan-2-one
CID 157464006
N-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 67035538
2-methyl-4-(3-morpholin-4-ylquinoxalin-6-yl)aniline
CID 67035841

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one?
The IUPAC name of 1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one (CID 158380673) is 1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one.
What is the SMILES notation for 1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one?
The canonical SMILES for 1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one is O=C(Cc1ccc(-c2ccc3ncc(N4CCOCC4)nc3c2)cc1)CC1CC1.
What is the InChIKey of 1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one?
The InChIKey is GVTARWNJTPEOMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c28-21(13-17-1-2-17)14-18-3-5-19(6-4-18)20-7-8-22-23(15-20)26-24(16-25-22)27-9-11-29-12-10-27/h3-8,15-17H,1-2,9-14H2.
What are the key properties of 1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one?
1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one has a molecular weight of 387.48 g/mol, XLogP of 4.05, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one is sourced from PubChem (CID 158380673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).