methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate

C14H17NO6 — CID 62952792

IUPACmethyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate
SMILESCOC(=O)CN(CC(=O)OC)C(=O)c1cccc(OC)c1
InChIInChI=1S/C14H17NO6/c1-19-11-6-4-5-10(7-11)14(18)15(8-12(16)20-2)9-13(17)21-3/h4-7H,8-9H2,1-3H3
InChIKeyFGIPTXQAGYRPBE-UHFFFAOYSA-N
MW295.29 g/mol
LogP0.48
Rot. Bonds6

About methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate

methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate (PubChem CID 62952792) has the molecular formula C14H17NO6 and a molecular weight of 295.29 g/mol. Its IUPAC name is methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate
PubChem CID62952792
Molecular FormulaC14H17NO6
Molecular Weight295.29 g/mol
Exact Mass295.11
IUPAC Namemethyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate
SMILESCOC(=O)CN(CC(=O)OC)C(=O)c1cccc(OC)c1
InChIInChI=1S/C14H17NO6/c1-19-11-6-4-5-10(7-11)14(18)15(8-12(16)20-2)9-13(17)21-3/h4-7H,8-9H2,1-3H3
InChIKeyFGIPTXQAGYRPBE-UHFFFAOYSA-N
XLogP0.48
TPSA82.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.29
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-[(3-methoxybenzoyl)-propan-2-ylamino]acetate
CID 54941995
methyl 2-[cyclopentyl-(3-methoxybenzoyl)amino]acetate
CID 80717814
3-methoxy-N,N-dipropylbenzamide
CID 669439
N,N-dihydroxy-3-methoxybenzamide
CID 91426750
N,N-bis(2-cyanoethyl)-3-methoxybenzamide
CID 4626859
methyl 2-[benzoyl(ethyl)amino]acetate
CID 57002755
N-(2-bromoethyl)-N-ethyl-3-methoxybenzamide
CID 80659973
methyl 2-[benzyl-(6-methoxynaphthalene-2-carbonyl)amino]acetate
CID 110169903
N-ethyl-3-methoxy-N-methylbenzamide
CID 15816607
3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
CID 2167030
N-[4-(diethylcarbamoyl)phenyl]-3-methoxybenzamide
CID 7942192
3-N,3-N-diethyl-1-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109055870

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate?
The IUPAC name of methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate (CID 62952792) is methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate.
What is the SMILES notation for methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate?
The canonical SMILES for methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate is COC(=O)CN(CC(=O)OC)C(=O)c1cccc(OC)c1.
What is the InChIKey of methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate?
The InChIKey is FGIPTXQAGYRPBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO6/c1-19-11-6-4-5-10(7-11)14(18)15(8-12(16)20-2)9-13(17)21-3/h4-7H,8-9H2,1-3H3.
What are the key properties of methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate?
methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate has a molecular weight of 295.29 g/mol, XLogP of 0.48, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate is sourced from PubChem (CID 62952792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).