methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate

C19H17ClN2O4 — CID 18200069

IUPACmethyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate
SMILESCOC(=O)c1ccccc1NC(=O)c1ccc(Cl)c(N2CCCC2=O)c1
InChIInChI=1S/C19H17ClN2O4/c1-26-19(25)13-5-2-3-6-15(13)21-18(24)12-8-9-14(20)16(11-12)22-10-4-7-17(22)23/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,21,24)
InChIKeySQTIDROYONTFLY-UHFFFAOYSA-N
MW372.81 g/mol
LogP3.51
Rot. Bonds4

About methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate

methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate (PubChem CID 18200069) has the molecular formula C19H17ClN2O4 and a molecular weight of 372.81 g/mol. Its IUPAC name is methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate.

Molecular Properties

Compound Namemethyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate
PubChem CID18200069
Molecular FormulaC19H17ClN2O4
Molecular Weight372.81 g/mol
Exact Mass372.09
IUPAC Namemethyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate
SMILESCOC(=O)c1ccccc1NC(=O)c1ccc(Cl)c(N2CCCC2=O)c1
InChIInChI=1S/C19H17ClN2O4/c1-26-19(25)13-5-2-3-6-15(13)21-18(24)12-8-9-14(20)16(11-12)22-10-4-7-17(22)23/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,21,24)
InChIKeySQTIDROYONTFLY-UHFFFAOYSA-N
XLogP3.51
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.81
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate with MolForge

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Related Compounds

4-chloro-N-(5-chloro-2-methoxyphenyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9068775
4-chloro-N-(4-methoxyphenyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9042234
methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-1,3-thiazole-5-carboxylate
CID 18103779
4-chloro-N-(4-methylphenyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9042083
4-chloro-N-[4-(4-methoxyanilino)phenyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 18292701
N-benzhydryl-4-chloro-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9046061
4-chloro-3-(2-oxopyrrolidin-1-yl)-N-[(1S)-1-phenylethyl]benzamide
CID 9032786
2,5-dichloro-N-[2-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 26709772
4-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 16564145
methyl 3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-phenylpropanoate
CID 24516853
N'-[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]furan-2-carbohydrazide
CID 9367033
methyl 2-[[2-[4-(2-oxopyrrolidin-1-yl)benzoyl]oxyacetyl]amino]benzoate
CID 7953013

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate?
The IUPAC name of methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate (CID 18200069) is methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate.
What is the SMILES notation for methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate?
The canonical SMILES for methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate is COC(=O)c1ccccc1NC(=O)c1ccc(Cl)c(N2CCCC2=O)c1.
What is the InChIKey of methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate?
The InChIKey is SQTIDROYONTFLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O4/c1-26-19(25)13-5-2-3-6-15(13)21-18(24)12-8-9-14(20)16(11-12)22-10-4-7-17(22)23/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,21,24).
What are the key properties of methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate?
methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate has a molecular weight of 372.81 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate is sourced from PubChem (CID 18200069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).