7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one

C22H24N2O4 — CID 18771363

IUPAC7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one
SMILESCOc1ccc(-c2cn(C)c3cc(OC)cc(N4CCOCC4)c3c2=O)cc1
InChIInChI=1S/C22H24N2O4/c1-23-14-18(15-4-6-16(26-2)7-5-15)22(25)21-19(23)12-17(27-3)13-20(21)24-8-10-28-11-9-24/h4-7,12-14H,8-11H2,1-3H3
InChIKeyBPLQZFOVXROWBX-UHFFFAOYSA-N
MW380.44 g/mol
LogP3.06
Rot. Bonds4

About 7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one

7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one (PubChem CID 18771363) has the molecular formula C22H24N2O4 and a molecular weight of 380.44 g/mol. Its IUPAC name is 7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one.

Molecular Properties

Compound Name7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one
PubChem CID18771363
Molecular FormulaC22H24N2O4
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC Name7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one
SMILESCOc1ccc(-c2cn(C)c3cc(OC)cc(N4CCOCC4)c3c2=O)cc1
InChIInChI=1S/C22H24N2O4/c1-23-14-18(15-4-6-16(26-2)7-5-15)22(25)21-19(23)12-17(27-3)13-20(21)24-8-10-28-11-9-24/h4-7,12-14H,8-11H2,1-3H3
InChIKeyBPLQZFOVXROWBX-UHFFFAOYSA-N
XLogP3.06
TPSA52.93 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.44
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one?
The IUPAC name of 7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one (CID 18771363) is 7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one.
What is the SMILES notation for 7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one?
The canonical SMILES for 7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one is COc1ccc(-c2cn(C)c3cc(OC)cc(N4CCOCC4)c3c2=O)cc1.
What is the InChIKey of 7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one?
The InChIKey is BPLQZFOVXROWBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O4/c1-23-14-18(15-4-6-16(26-2)7-5-15)22(25)21-19(23)12-17(27-3)13-20(21)24-8-10-28-11-9-24/h4-7,12-14H,8-11H2,1-3H3.
What are the key properties of 7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one?
7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one has a molecular weight of 380.44 g/mol, XLogP of 3.06, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-3-(4-methoxyphenyl)-1-methyl-5-morpholin-4-ylquinolin-4-one is sourced from PubChem (CID 18771363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).