3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one

C22H24N2O3 — CID 56875111

IUPAC3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one
SMILESCOc1cccc(CC2CN(Cc3cc4ccccc4[nH]c3=O)CCO2)c1
InChIInChI=1S/C22H24N2O3/c1-26-19-7-4-5-16(11-19)12-20-15-24(9-10-27-20)14-18-13-17-6-2-3-8-21(17)23-22(18)25/h2-8,11,13,20H,9-10,12,14-15H2,1H3,(H,23,25)
InChIKeyRASILXKIEAEEAF-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.98
Rot. Bonds5

About 3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one

3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one (PubChem CID 56875111) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is 3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one
PubChem CID56875111
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC Name3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one
SMILESCOc1cccc(CC2CN(Cc3cc4ccccc4[nH]c3=O)CCO2)c1
InChIInChI=1S/C22H24N2O3/c1-26-19-7-4-5-16(11-19)12-20-15-24(9-10-27-20)14-18-13-17-6-2-3-8-21(17)23-22(18)25/h2-8,11,13,20H,9-10,12,14-15H2,1H3,(H,23,25)
InChIKeyRASILXKIEAEEAF-UHFFFAOYSA-N
XLogP2.98
TPSA54.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-2-[(3-methoxyphenyl)methyl]morpholine
CID 56873494
2-[(3-methoxyphenyl)methyl]-4-[(3,5,6-trimethylpyrazin-2-yl)methyl]morpholine
CID 45237658
N-[2-[4-[(2-oxo-1H-quinolin-3-yl)methyl]morpholin-2-yl]ethyl]acetamide
CID 56705307
2-[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]acetic acid
CID 102604207
(2S)-2-benzyl-4-[(2,4-dimethoxyphenyl)methyl]morpholine
CID 29024699
4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine
CID 142864926
2-[(3-methoxyphenyl)methyl]-4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]morpholine
CID 56870012
(2S)-2-[(3-methoxyphenyl)methyl]-4-[(5-methyl-1-propylpyrazol-4-yl)methyl]morpholine
CID 95550670
5-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-2,1,3-benzoxadiazole
CID 45232008
2-(chloromethyl)-4-[(3-methoxyphenyl)methyl]morpholine
CID 81213549
(2S)-2-[(3-methoxyphenyl)methyl]-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine
CID 95525046
(2R)-2-[(3-methoxyphenyl)methyl]-4-(3-methylsulfanylpropyl)morpholine
CID 29257197

Frequently Asked Questions

What is the IUPAC name of 3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one?
The IUPAC name of 3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one (CID 56875111) is 3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one.
What is the SMILES notation for 3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one?
The canonical SMILES for 3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one is COc1cccc(CC2CN(Cc3cc4ccccc4[nH]c3=O)CCO2)c1.
What is the InChIKey of 3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one?
The InChIKey is RASILXKIEAEEAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-26-19-7-4-5-16(11-19)12-20-15-24(9-10-27-20)14-18-13-17-6-2-3-8-21(17)23-22(18)25/h2-8,11,13,20H,9-10,12,14-15H2,1H3,(H,23,25).
What are the key properties of 3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one?
3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one has a molecular weight of 364.45 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methyl]-1H-quinolin-2-one is sourced from PubChem (CID 56875111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).