6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one

C19H18N2O3 — CID 59237493

IUPAC6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one
SMILESO=c1cc(Oc2ccccc2)c2cc(N3CCOCC3)ccc2[nH]1
InChIInChI=1S/C19H18N2O3/c22-19-13-18(24-15-4-2-1-3-5-15)16-12-14(6-7-17(16)20-19)21-8-10-23-11-9-21/h1-7,12-13H,8-11H2,(H,20,22)
InChIKeyVBYQVQICRPLNDN-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.16
Rot. Bonds3

About 6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one

6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one (PubChem CID 59237493) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one.

Molecular Properties

Compound Name6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one
PubChem CID59237493
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one
SMILESO=c1cc(Oc2ccccc2)c2cc(N3CCOCC3)ccc2[nH]1
InChIInChI=1S/C19H18N2O3/c22-19-13-18(24-15-4-2-1-3-5-15)16-12-14(6-7-17(16)20-19)21-8-10-23-11-9-21/h1-7,12-13H,8-11H2,(H,20,22)
InChIKeyVBYQVQICRPLNDN-UHFFFAOYSA-N
XLogP3.16
TPSA54.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one?
The IUPAC name of 6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one (CID 59237493) is 6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one.
What is the SMILES notation for 6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one?
The canonical SMILES for 6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one is O=c1cc(Oc2ccccc2)c2cc(N3CCOCC3)ccc2[nH]1.
What is the InChIKey of 6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one?
The InChIKey is VBYQVQICRPLNDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c22-19-13-18(24-15-4-2-1-3-5-15)16-12-14(6-7-17(16)20-19)21-8-10-23-11-9-21/h1-7,12-13H,8-11H2,(H,20,22).
What are the key properties of 6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one?
6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one has a molecular weight of 322.36 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-4-phenoxy-1H-quinolin-2-one is sourced from PubChem (CID 59237493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).