methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate

C11H11Cl2NO3 — CID 43422763

IUPACmethyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate
SMILESCOC(=O)CN(C)C(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C11H11Cl2NO3/c1-14(6-9(15)17-2)11(16)10-7(12)4-3-5-8(10)13/h3-5H,6H2,1-2H3
InChIKeyRPFBKXOJQOPUGO-UHFFFAOYSA-N
MW276.12 g/mol
LogP2.24
Rot. Bonds3

About methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate

methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate (PubChem CID 43422763) has the molecular formula C11H11Cl2NO3 and a molecular weight of 276.12 g/mol. Its IUPAC name is methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate.

Molecular Properties

Compound Namemethyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate
PubChem CID43422763
Molecular FormulaC11H11Cl2NO3
Molecular Weight276.12 g/mol
Exact Mass275.01
IUPAC Namemethyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate
SMILESCOC(=O)CN(C)C(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C11H11Cl2NO3/c1-14(6-9(15)17-2)11(16)10-7(12)4-3-5-8(10)13/h3-5H,6H2,1-2H3
InChIKeyRPFBKXOJQOPUGO-UHFFFAOYSA-N
XLogP2.24
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.12
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze methyl 2-[(2,6-dichlorobenzoyl)-methylamino]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-[(2,6-dichlorobenzoyl)-propan-2-ylamino]acetate
CID 55005992
methyl 2-[(3-chloro-2-fluorobenzoyl)-methylamino]acetate
CID 80979404
methyl 2-[(3-bromo-2-chlorobenzoyl)-methylamino]acetate
CID 103994339
methyl 3-[(2,6-dichlorobenzoyl)-methylamino]-2-methylpropanoate
CID 55008393
methyl 2-[(3-chloro-4-methylbenzoyl)-methylamino]acetate
CID 63194919
methyl 2-[(2-chloro-4-methylbenzoyl)-methylamino]acetate
CID 106509702
methyl 2-[(2-methoxy-6-nitrobenzoyl)-methylamino]acetate
CID 81414362
methyl 2-[(3-chloro-2-fluorophenyl)methyl-(2-methoxy-2-oxoethyl)amino]acetate
CID 103885183
2-amino-6-chloro-N-[2-(dimethylamino)-2-oxoethyl]-N-methylbenzamide
CID 63660537
2-chloro-6-fluoro-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methylbenzamide
CID 51307804
methyl 2-[(4-iodobenzoyl)-methylamino]acetate
CID 43407349
methyl 2-[furan-2-carbonyl(methyl)amino]acetate
CID 43407344

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate?
The IUPAC name of methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate (CID 43422763) is methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate.
What is the SMILES notation for methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate?
The canonical SMILES for methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate is COC(=O)CN(C)C(=O)c1c(Cl)cccc1Cl.
What is the InChIKey of methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate?
The InChIKey is RPFBKXOJQOPUGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl2NO3/c1-14(6-9(15)17-2)11(16)10-7(12)4-3-5-8(10)13/h3-5H,6H2,1-2H3.
What are the key properties of methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate?
methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate has a molecular weight of 276.12 g/mol, XLogP of 2.24, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2,6-dichlorobenzoyl)-methylamino]acetate is sourced from PubChem (CID 43422763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).