2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate

C26H29NO5 — CID 161099806

IUPAC2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate
SMILESCOC(=O)Cc1ccc(OC)cc1.COc1ccc(CC(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C16H17NO2.C10H12O3/c1-12-3-7-14(8-4-12)17-16(18)11-13-5-9-15(19-2)10-6-13;1-12-9-5-3-8(4-6-9)7-10(11)13-2/h3-10H,11H2,1-2H3,(H,17,18);3-6H,7H2,1-2H3
InChIKeyUIGQUCZYIMQOJD-UHFFFAOYSA-N
MW435.52 g/mol
LogP4.60
Rot. Bonds7

About 2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate

2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate (PubChem CID 161099806) has the molecular formula C26H29NO5 and a molecular weight of 435.52 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate
PubChem CID161099806
Molecular FormulaC26H29NO5
Molecular Weight435.52 g/mol
Exact Mass435.20
IUPAC Name2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate
SMILESCOC(=O)Cc1ccc(OC)cc1.COc1ccc(CC(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C16H17NO2.C10H12O3/c1-12-3-7-14(8-4-12)17-16(18)11-13-5-9-15(19-2)10-6-13;1-12-9-5-3-8(4-6-9)7-10(11)13-2/h3-10H,11H2,1-2H3,(H,17,18);3-6H,7H2,1-2H3
InChIKeyUIGQUCZYIMQOJD-UHFFFAOYSA-N
XLogP4.60
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.52
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[4-(4-methoxyanilino)phenyl]acetate
CID 82535736
N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 112998708
N-(4-methoxyphenyl)-2-[(4-methylphenyl)methylamino]acetamide
CID 19164026
N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide
CID 17202461
N-[4-(2-chloroethyl)phenyl]-2-(4-methoxyphenyl)acetamide
CID 114299189
N-[4-(2-aminoethyl)phenyl]-2-(4-methoxyphenyl)acetamide
CID 28754535
N-(4-methylphenyl)-2-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide
CID 110437429
N-[4-[3-methoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]-2-(4-methoxyphenyl)acetamide
CID 1026844
N-(4-methoxyphenyl)-2-pyridin-4-ylacetamide
CID 110697333
2-(4-methoxyphenyl)-N-pyridin-4-ylacetamide
CID 4228325
N-(4-methoxyphenyl)-2-(4-methylsulfonylphenyl)acetamide
CID 41139632
2-[4-(difluoromethoxy)phenyl]-N-(4-methylphenyl)acetamide
CID 33142215

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate?
The IUPAC name of 2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate (CID 161099806) is 2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate?
The canonical SMILES for 2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate is COC(=O)Cc1ccc(OC)cc1.COc1ccc(CC(=O)Nc2ccc(C)cc2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate?
The InChIKey is UIGQUCZYIMQOJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2.C10H12O3/c1-12-3-7-14(8-4-12)17-16(18)11-13-5-9-15(19-2)10-6-13;1-12-9-5-3-8(4-6-9)7-10(11)13-2/h3-10H,11H2,1-2H3,(H,17,18);3-6H,7H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate?
2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate has a molecular weight of 435.52 g/mol, XLogP of 4.60, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate is sourced from PubChem (CID 161099806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).