6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one

C20H20N2O2 — CID 742145

IUPAC6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one
SMILESCc1ccc2[nH]c(=O)c(N3CCOCC3)c(-c3ccccc3)c2c1
InChIInChI=1S/C20H20N2O2/c1-14-7-8-17-16(13-14)18(15-5-3-2-4-6-15)19(20(23)21-17)22-9-11-24-12-10-22/h2-8,13H,9-12H2,1H3,(H,21,23)
InChIKeyCSPCZTUJVYOVLE-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.34
Rot. Bonds2

About 6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one

6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one (PubChem CID 742145) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one.

Molecular Properties

Compound Name6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one
PubChem CID742145
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one
SMILESCc1ccc2[nH]c(=O)c(N3CCOCC3)c(-c3ccccc3)c2c1
InChIInChI=1S/C20H20N2O2/c1-14-7-8-17-16(13-14)18(15-5-3-2-4-6-15)19(20(23)21-17)22-9-11-24-12-10-22/h2-8,13H,9-12H2,1H3,(H,21,23)
InChIKeyCSPCZTUJVYOVLE-UHFFFAOYSA-N
XLogP3.34
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one?
The IUPAC name of 6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one (CID 742145) is 6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one.
What is the SMILES notation for 6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one?
The canonical SMILES for 6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one is Cc1ccc2[nH]c(=O)c(N3CCOCC3)c(-c3ccccc3)c2c1.
What is the InChIKey of 6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one?
The InChIKey is CSPCZTUJVYOVLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-14-7-8-17-16(13-14)18(15-5-3-2-4-6-15)19(20(23)21-17)22-9-11-24-12-10-22/h2-8,13H,9-12H2,1H3,(H,21,23).
What are the key properties of 6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one?
6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one has a molecular weight of 320.39 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one is sourced from PubChem (CID 742145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).