N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide

C20H23BrN2O4 — CID 46813553

IUPACN-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2cc(Br)ccc2N2CCOCC2)c(OC)c1
InChIInChI=1S/C20H23BrN2O4/c1-25-16-5-3-14(19(13-16)26-2)11-20(24)22-17-12-15(21)4-6-18(17)23-7-9-27-10-8-23/h3-6,12-13H,7-11H2,1-2H3,(H,22,24)
InChIKeyOEHBLEHGWFTHHK-UHFFFAOYSA-N
MW435.32 g/mol
LogP3.48
Rot. Bonds6

About N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide

N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide (PubChem CID 46813553) has the molecular formula C20H23BrN2O4 and a molecular weight of 435.32 g/mol. Its IUPAC name is N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide
PubChem CID46813553
Molecular FormulaC20H23BrN2O4
Molecular Weight435.32 g/mol
Exact Mass434.08
IUPAC NameN-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2cc(Br)ccc2N2CCOCC2)c(OC)c1
InChIInChI=1S/C20H23BrN2O4/c1-25-16-5-3-14(19(13-16)26-2)11-20(24)22-17-12-15(21)4-6-18(17)23-7-9-27-10-8-23/h3-6,12-13H,7-11H2,1-2H3,(H,22,24)
InChIKeyOEHBLEHGWFTHHK-UHFFFAOYSA-N
XLogP3.48
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.32
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-bromo-2-morpholin-4-ylphenyl)-2-(3-methoxyphenyl)acetamide
CID 55363801
N-(5-bromo-2-morpholin-4-ylphenyl)-2-(methylamino)acetamide
CID 119833776
N-(5-bromo-2-morpholin-4-ylphenyl)-2-(4-fluorophenyl)acetamide
CID 55363743
N-(5-bromo-2-morpholin-4-ylphenyl)-2-methoxy-5-methylbenzamide
CID 55394956
2-(2-bromo-4,5-dimethoxyphenyl)-N-(2-morpholin-4-ylphenyl)acetamide
CID 17426993
2-(2-methoxyphenyl)-N-(2-morpholin-4-ylphenyl)acetamide
CID 2677631
N-(5-bromo-2-morpholin-4-ylphenyl)-2-cyanoacetamide
CID 86797592
N-(5-methoxy-2-morpholin-4-ylphenyl)-2-phenoxyacetamide
CID 6471849
4-acetamido-N-[(2,4-dimethoxyphenyl)methyl]-2-morpholin-4-ylbenzamide
CID 53146056
N-(5-bromo-2-pyrrolidin-1-ylphenyl)-2-(3-fluoro-4-methoxyphenyl)acetamide
CID 75382210
N-(5-chloro-2-morpholin-4-ylphenyl)-2-(4-methoxyphenoxy)acetamide
CID 1094305
N-(1,3-dimethyl-6-morpholin-4-yl-2-oxobenzimidazol-5-yl)-2-(4-methoxyphenyl)acetamide
CID 22433047

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide?
The IUPAC name of N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide (CID 46813553) is N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide.
What is the SMILES notation for N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide?
The canonical SMILES for N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide is COc1ccc(CC(=O)Nc2cc(Br)ccc2N2CCOCC2)c(OC)c1.
What is the InChIKey of N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide?
The InChIKey is OEHBLEHGWFTHHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23BrN2O4/c1-25-16-5-3-14(19(13-16)26-2)11-20(24)22-17-12-15(21)4-6-18(17)23-7-9-27-10-8-23/h3-6,12-13H,7-11H2,1-2H3,(H,22,24).
What are the key properties of N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide?
N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide has a molecular weight of 435.32 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-morpholin-4-ylphenyl)-2-(2,4-dimethoxyphenyl)acetamide is sourced from PubChem (CID 46813553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).