morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone

C17H19N3O2 — CID 163353117

IUPACmorpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone
SMILESO=C(C1CN(c2ccc3ccccc3n2)C1)N1CCOCC1
InChIInChI=1S/C17H19N3O2/c21-17(19-7-9-22-10-8-19)14-11-20(12-14)16-6-5-13-3-1-2-4-15(13)18-16/h1-6,14H,7-12H2
InChIKeyVYZJLPPNUKAYCS-UHFFFAOYSA-N
MW297.36 g/mol
LogP1.53
Rot. Bonds2

About morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone

morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone (PubChem CID 163353117) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone
PubChem CID163353117
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Namemorpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone
SMILESO=C(C1CN(c2ccc3ccccc3n2)C1)N1CCOCC1
InChIInChI=1S/C17H19N3O2/c21-17(19-7-9-22-10-8-19)14-11-20(12-14)16-6-5-13-3-1-2-4-15(13)18-16/h1-6,14H,7-12H2
InChIKeyVYZJLPPNUKAYCS-UHFFFAOYSA-N
XLogP1.53
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone?
The IUPAC name of morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone (CID 163353117) is morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone.
What is the SMILES notation for morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone?
The canonical SMILES for morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone is O=C(C1CN(c2ccc3ccccc3n2)C1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone?
The InChIKey is VYZJLPPNUKAYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c21-17(19-7-9-22-10-8-19)14-11-20(12-14)16-6-5-13-3-1-2-4-15(13)18-16/h1-6,14H,7-12H2.
What are the key properties of morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone?
morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone has a molecular weight of 297.36 g/mol, XLogP of 1.53, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-(1-quinolin-2-ylazetidin-3-yl)methanone is sourced from PubChem (CID 163353117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).