4-(3-phenylquinoxalin-2-yl)morpholine

C18H17N3O — CID 646980

IUPAC4-(3-phenylquinoxalin-2-yl)morpholine
SMILESc1ccc(-c2nc3ccccc3nc2N2CCOCC2)cc1
InChIInChI=1S/C18H17N3O/c1-2-6-14(7-3-1)17-18(21-10-12-22-13-11-21)20-16-9-5-4-8-15(16)19-17/h1-9H,10-13H2
InChIKeyRWEUKCVVFYRGJN-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.13
Rot. Bonds2

About 4-(3-phenylquinoxalin-2-yl)morpholine

4-(3-phenylquinoxalin-2-yl)morpholine (PubChem CID 646980) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is 4-(3-phenylquinoxalin-2-yl)morpholine.

Molecular Properties

Compound Name4-(3-phenylquinoxalin-2-yl)morpholine
PubChem CID646980
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC Name4-(3-phenylquinoxalin-2-yl)morpholine
SMILESc1ccc(-c2nc3ccccc3nc2N2CCOCC2)cc1
InChIInChI=1S/C18H17N3O/c1-2-6-14(7-3-1)17-18(21-10-12-22-13-11-21)20-16-9-5-4-8-15(16)19-17/h1-9H,10-13H2
InChIKeyRWEUKCVVFYRGJN-UHFFFAOYSA-N
XLogP3.13
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-phenylquinoxalin-2-yl)morpholine?
The IUPAC name of 4-(3-phenylquinoxalin-2-yl)morpholine (CID 646980) is 4-(3-phenylquinoxalin-2-yl)morpholine.
What is the SMILES notation for 4-(3-phenylquinoxalin-2-yl)morpholine?
The canonical SMILES for 4-(3-phenylquinoxalin-2-yl)morpholine is c1ccc(-c2nc3ccccc3nc2N2CCOCC2)cc1.
What is the InChIKey of 4-(3-phenylquinoxalin-2-yl)morpholine?
The InChIKey is RWEUKCVVFYRGJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O/c1-2-6-14(7-3-1)17-18(21-10-12-22-13-11-21)20-16-9-5-4-8-15(16)19-17/h1-9H,10-13H2.
What are the key properties of 4-(3-phenylquinoxalin-2-yl)morpholine?
4-(3-phenylquinoxalin-2-yl)morpholine has a molecular weight of 291.35 g/mol, XLogP of 3.13, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenylquinoxalin-2-yl)morpholine is sourced from PubChem (CID 646980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).