methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate

C14H19NO4 — CID 31922197

IUPACmethyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate
SMILESCCOc1ccc(C(=O)NC(C)(C)C(=O)OC)cc1
InChIInChI=1S/C14H19NO4/c1-5-19-11-8-6-10(7-9-11)12(16)15-14(2,3)13(17)18-4/h6-9H,5H2,1-4H3,(H,15,16)
InChIKeyUZXGNDPGVRBOPO-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.77
Rot. Bonds5

About methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate

methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate (PubChem CID 31922197) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate.

Molecular Properties

Compound Namemethyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate
PubChem CID31922197
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Namemethyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate
SMILESCCOc1ccc(C(=O)NC(C)(C)C(=O)OC)cc1
InChIInChI=1S/C14H19NO4/c1-5-19-11-8-6-10(7-9-11)12(16)15-14(2,3)13(17)18-4/h6-9H,5H2,1-4H3,(H,15,16)
InChIKeyUZXGNDPGVRBOPO-UHFFFAOYSA-N
XLogP1.77
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[(4-butoxybenzoyl)amino]-2-methylpropanoate
CID 31922159
2-[[4-(2-methoxyethoxy)benzoyl]amino]-2-methylpropanoic acid
CID 75383535
N-[1-chloro-2-(chloromethyl)butan-2-yl]-4-ethoxybenzamide
CID 107867677
N-(1-amino-2-methyl-1-sulfanylidenebutan-2-yl)-4-ethoxybenzamide
CID 61118814
methyl 2-(4-ethoxyphenyl)-3-hydroxy-2-methylpropanoate
CID 21348092
4-butoxy-N-tert-butylbenzamide
CID 60643031
methyl 3-(4-ethoxyphenyl)-2,2-dimethylpropanoate
CID 116927544
4-ethoxy-N-oxaldehydoylbenzamide
CID 23085538
N-[2-(2,2-dimethylpropanoylamino)ethyl]-4-ethoxybenzamide
CID 108540579
methyl 2-[4-[2-(4-ethoxyphenyl)ethynyl]phenyl]-2-methylpropanoate
CID 125497316
2-methyl-2-[[4-(2,2,2-trifluoroethoxy)benzoyl]amino]propanoic acid
CID 119187579
methyl 2-[[2-(4-ethylphenoxy)acetyl]amino]-2-methylpropanoate
CID 30875979

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate?
The IUPAC name of methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate (CID 31922197) is methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate.
What is the SMILES notation for methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate?
The canonical SMILES for methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate is CCOc1ccc(C(=O)NC(C)(C)C(=O)OC)cc1.
What is the InChIKey of methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate?
The InChIKey is UZXGNDPGVRBOPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-5-19-11-8-6-10(7-9-11)12(16)15-14(2,3)13(17)18-4/h6-9H,5H2,1-4H3,(H,15,16).
What are the key properties of methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate?
methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate has a molecular weight of 265.31 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(4-ethoxybenzoyl)amino]-2-methylpropanoate is sourced from PubChem (CID 31922197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).