[2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone

C22H22N2O3 — CID 42750037

IUPAC[2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone
SMILESCOc1cccc(-c2cc(C(=O)N3CCOCC3)c3cc(C)ccc3n2)c1
InChIInChI=1S/C22H22N2O3/c1-15-6-7-20-18(12-15)19(22(25)24-8-10-27-11-9-24)14-21(23-20)16-4-3-5-17(13-16)26-2/h3-7,12-14H,8-11H2,1-2H3
InChIKeyVTDXJAJUMZWHMY-UHFFFAOYSA-N
MW362.43 g/mol
LogP3.69
Rot. Bonds3

About [2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone

[2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone (PubChem CID 42750037) has the molecular formula C22H22N2O3 and a molecular weight of 362.43 g/mol. Its IUPAC name is [2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone
PubChem CID42750037
Molecular FormulaC22H22N2O3
Molecular Weight362.43 g/mol
Exact Mass362.16
IUPAC Name[2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone
SMILESCOc1cccc(-c2cc(C(=O)N3CCOCC3)c3cc(C)ccc3n2)c1
InChIInChI=1S/C22H22N2O3/c1-15-6-7-20-18(12-15)19(22(25)24-8-10-27-11-9-24)14-21(23-20)16-4-3-5-17(13-16)26-2/h3-7,12-14H,8-11H2,1-2H3
InChIKeyVTDXJAJUMZWHMY-UHFFFAOYSA-N
XLogP3.69
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[6-bromo-2-(3-methoxyphenyl)quinolin-4-yl]-morpholin-4-ylmethanone
CID 2965405
[2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 4244399
[6-(3-methoxyphenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone
CID 134801381
2-(3-methoxyphenyl)-6-methylquinoline-4-carboxylate
CID 4744706
[2-(3-methoxyphenyl)quinolin-4-yl]-piperidin-1-ylmethanone
CID 896066
[2-(3-methoxyphenyl)quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone
CID 4256561
[2-[3-(2-methylpropoxy)phenyl]quinolin-4-yl]-morpholin-4-ylmethanone
CID 1023123
[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-(6-methyl-2-pyridin-3-ylquinolin-4-yl)methanone
CID 1261440
[2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone
CID 42749654
[2-(2,3-dihydrofuran-5-yl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone
CID 71027528
[4-(4-methoxyphenyl)piperazin-1-yl]-(6-methyl-2-pyridin-4-ylquinolin-4-yl)methanone
CID 17375510
[2-(4-methoxyphenyl)-6-methylquinolin-4-yl]-[4-(2-methylphenyl)piperazin-1-yl]methanone
CID 3369416

Frequently Asked Questions

What is the IUPAC name of [2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone (CID 42750037) is [2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone is COc1cccc(-c2cc(C(=O)N3CCOCC3)c3cc(C)ccc3n2)c1.
What is the InChIKey of [2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is VTDXJAJUMZWHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O3/c1-15-6-7-20-18(12-15)19(22(25)24-8-10-27-11-9-24)14-21(23-20)16-4-3-5-17(13-16)26-2/h3-7,12-14H,8-11H2,1-2H3.
What are the key properties of [2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone?
[2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 362.43 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 42750037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).