morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone

C19H23N3O3 — CID 94476970

IUPACmorpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone
SMILESO=C(c1cc(NC[C@H]2CCCO2)nc2ccccc12)N1CCOCC1
InChIInChI=1S/C19H23N3O3/c23-19(22-7-10-24-11-8-22)16-12-18(20-13-14-4-3-9-25-14)21-17-6-2-1-5-15(16)17/h1-2,5-6,12,14H,3-4,7-11,13H2,(H,20,21)/t14-/m1/s1
InChIKeyJTZKQPOSFIWTFT-CQSZACIVSA-N
MW341.41 g/mol
LogP2.30
Rot. Bonds4

About morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone

morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone (PubChem CID 94476970) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone
PubChem CID94476970
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Namemorpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone
SMILESO=C(c1cc(NC[C@H]2CCCO2)nc2ccccc12)N1CCOCC1
InChIInChI=1S/C19H23N3O3/c23-19(22-7-10-24-11-8-22)16-12-18(20-13-14-4-3-9-25-14)21-17-6-2-1-5-15(16)17/h1-2,5-6,12,14H,3-4,7-11,13H2,(H,20,21)/t14-/m1/s1
InChIKeyJTZKQPOSFIWTFT-CQSZACIVSA-N
XLogP2.30
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone?
The IUPAC name of morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone (CID 94476970) is morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone?
The canonical SMILES for morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone is O=C(c1cc(NC[C@H]2CCCO2)nc2ccccc12)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone?
The InChIKey is JTZKQPOSFIWTFT-CQSZACIVSA-N. The full InChI is InChI=1S/C19H23N3O3/c23-19(22-7-10-24-11-8-22)16-12-18(20-13-14-4-3-9-25-14)21-17-6-2-1-5-15(16)17/h1-2,5-6,12,14H,3-4,7-11,13H2,(H,20,21)/t14-/m1/s1.
What are the key properties of morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone?
morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone has a molecular weight of 341.41 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[2-[[(2R)-oxolan-2-yl]methylamino]quinolin-4-yl]methanone is sourced from PubChem (CID 94476970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).