[2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate

C14H15ClN2O4 — CID 2108224

IUPAC[2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate
SMILESO=C(COC(=O)CNC(=O)c1ccccc1Cl)NC1CC1
InChIInChI=1S/C14H15ClN2O4/c15-11-4-2-1-3-10(11)14(20)16-7-13(19)21-8-12(18)17-9-5-6-9/h1-4,9H,5-8H2,(H,16,20)(H,17,18)
InChIKeyQKAUOMDOFUVPPL-UHFFFAOYSA-N
MW310.74 g/mol
LogP0.89
Rot. Bonds6

About [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate

[2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate (PubChem CID 2108224) has the molecular formula C14H15ClN2O4 and a molecular weight of 310.74 g/mol. Its IUPAC name is [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate.

Molecular Properties

Compound Name[2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate
PubChem CID2108224
Molecular FormulaC14H15ClN2O4
Molecular Weight310.74 g/mol
Exact Mass310.07
IUPAC Name[2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate
SMILESO=C(COC(=O)CNC(=O)c1ccccc1Cl)NC1CC1
InChIInChI=1S/C14H15ClN2O4/c15-11-4-2-1-3-10(11)14(20)16-7-13(19)21-8-12(18)17-9-5-6-9/h1-4,9H,5-8H2,(H,16,20)(H,17,18)
InChIKeyQKAUOMDOFUVPPL-UHFFFAOYSA-N
XLogP0.89
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.74
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)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

[2-(Ethylamino)-2-oxoethyl] 3-[(4-chlorobenzoyl)amino]propanoate
CID 2571604
Methyl 2-[(3-chlorophenyl)carbonylamino]acetate
CID 669189
2-chloro-N-[2-(morpholin-4-yl)ethyl]benzamide
CID 799090
Acetic acid, 2-((2-chlorobenzoyl)amino)-
CID 177756
Glycine, N-(2-chlorobenzoyl)-, methyl ester
CID 531380
2-(2-Chlorophenyl)-2-oxoethyl (benzoylamino)acetate
CID 1615618
[2-(Cyclopentylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate
CID 2407437
(2-Oxooxolan-3-yl) 2-[(2-chlorobenzoyl)amino]acetate
CID 3908649
[2-(Cycloheptylamino)-2-oxoethyl] 2-[(4-chlorobenzoyl)amino]acetate
CID 4782978
[2-(cyclopropylamino)-2-oxoethyl] (2S)-2-[(2-fluorobenzoyl)amino]-3-methylbutanoate
CID 9502237
[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl] (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate
CID 16240695
[2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl] (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate
CID 16243298

Frequently Asked Questions

What is the IUPAC name of [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate?
The IUPAC name of [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate (CID 2108224) is [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate.
What is the SMILES notation for [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate?
The canonical SMILES for [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate is O=C(COC(=O)CNC(=O)c1ccccc1Cl)NC1CC1.
What is the InChIKey of [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate?
The InChIKey is QKAUOMDOFUVPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O4/c15-11-4-2-1-3-10(11)14(20)16-7-13(19)21-8-12(18)17-9-5-6-9/h1-4,9H,5-8H2,(H,16,20)(H,17,18).
What are the key properties of [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate?
[2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate has a molecular weight of 310.74 g/mol, XLogP of 0.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclopropylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate is sourced from PubChem (CID 2108224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).