2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate

C19H21NO4 — CID 42008768

IUPAC2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate
SMILESCOc1ccc(CCOC(=O)CNC(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C19H21NO4/c1-14-3-7-16(8-4-14)19(22)20-13-18(21)24-12-11-15-5-9-17(23-2)10-6-15/h3-10H,11-13H2,1-2H3,(H,20,22)
InChIKeyGCKLXZVHWFZLOT-UHFFFAOYSA-N
MW327.38 g/mol
LogP2.52
Rot. Bonds7

About 2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate

2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate (PubChem CID 42008768) has the molecular formula C19H21NO4 and a molecular weight of 327.38 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate.

Molecular Properties

Compound Name2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate
PubChem CID42008768
Molecular FormulaC19H21NO4
Molecular Weight327.38 g/mol
Exact Mass327.15
IUPAC Name2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate
SMILESCOc1ccc(CCOC(=O)CNC(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C19H21NO4/c1-14-3-7-16(8-4-14)19(22)20-13-18(21)24-12-11-15-5-9-17(23-2)10-6-15/h3-10H,11-13H2,1-2H3,(H,20,22)
InChIKeyGCKLXZVHWFZLOT-UHFFFAOYSA-N
XLogP2.52
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluorophenoxy)ethyl 2-[(4-methoxybenzoyl)amino]acetate
CID 8787743
2-(4-methoxyphenyl)ethyl 2-[(4-chloro-3-nitrobenzoyl)amino]acetate
CID 7877242
2-(4-methoxyphenoxy)ethyl 2-[(4-phenoxybenzoyl)amino]acetate
CID 7833306
N-[2-[(4-methoxybenzoyl)amino]ethyl]-4-methylbenzamide
CID 108537787
[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl] 2-[(4-phenylbenzoyl)amino]acetate
CID 35576363
[2-[(4-methylphenyl)methyl-propylamino]-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate
CID 9345553
[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-[(4-methoxybenzoyl)amino]acetate
CID 8788443
(4-methoxyphenyl)methyl 2-[[4-(trifluoromethyl)benzoyl]amino]acetate
CID 16578596
2-(2-fluorophenoxy)ethyl 2-[(4-methoxybenzoyl)amino]acetate
CID 8788015
[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-benzamidoacetate
CID 2625536
2-(4-methylphenoxy)ethyl 2-[(3,4-dichlorobenzoyl)amino]acetate
CID 7880664
[4-[(4-methylphenyl)carbamoyl]phenyl] 3-(4-methoxyphenyl)propanoate
CID 19221101

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate?
The IUPAC name of 2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate (CID 42008768) is 2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate.
What is the SMILES notation for 2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate?
The canonical SMILES for 2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate is COc1ccc(CCOC(=O)CNC(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate?
The InChIKey is GCKLXZVHWFZLOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO4/c1-14-3-7-16(8-4-14)19(22)20-13-18(21)24-12-11-15-5-9-17(23-2)10-6-15/h3-10H,11-13H2,1-2H3,(H,20,22).
What are the key properties of 2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate?
2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate has a molecular weight of 327.38 g/mol, XLogP of 2.52, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)ethyl 2-[(4-methylbenzoyl)amino]acetate is sourced from PubChem (CID 42008768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).