N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide

C13H15N3O3 — CID 9297068

IUPACN-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide
SMILESNC(=O)CNC(=O)c1ccccc1N1CCCC1=O
InChIInChI=1S/C13H15N3O3/c14-11(17)8-15-13(19)9-4-1-2-5-10(9)16-7-3-6-12(16)18/h1-2,4-5H,3,6-8H2,(H2,14,17)(H,15,19)
InChIKeySHJVCTYBNKXCDP-UHFFFAOYSA-N
MW261.28 g/mol
LogP0.03
Rot. Bonds4

About N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide

N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 9297068) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID9297068
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC NameN-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide
SMILESNC(=O)CNC(=O)c1ccccc1N1CCCC1=O
InChIInChI=1S/C13H15N3O3/c14-11(17)8-15-13(19)9-4-1-2-5-10(9)16-7-3-6-12(16)18/h1-2,4-5H,3,6-8H2,(H2,14,17)(H,15,19)
InChIKeySHJVCTYBNKXCDP-UHFFFAOYSA-N
XLogP0.03
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-oxopyrrolidin-1-yl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 8589720
2-(2-oxopyrrolidin-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 9210420
N-[2-(4-chlorophenoxy)ethyl]-2-(2-oxopyrrolidin-1-yl)benzamide
CID 9297806
N-(4-iodophenyl)-2-(2-oxopyrrolidin-1-yl)benzamide
CID 9139011
N-[(2,6-dimethoxy-3-pyridinyl)methyl]-2-(2-oxopyrrolidin-1-yl)benzamide
CID 139004492
N-(2,3-dihydro-1H-inden-5-yl)-2-(2-oxopyrrolidin-1-yl)benzamide
CID 8927653
N-(3,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)benzamide
CID 17428588
phenacyl 2-(2-oxopyrrolidin-1-yl)benzoate
CID 9131445
N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(2-oxopyrrolidin-1-yl)benzamide
CID 9405788
1-(2-hydroxyphenyl)pyrrolidin-2-one
CID 695303
N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide
CID 8968015
(2-fluorophenyl)methyl 2-(2-oxopyrrolidin-1-yl)benzoate
CID 9130969

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide (CID 9297068) is N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide is NC(=O)CNC(=O)c1ccccc1N1CCCC1=O.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is SHJVCTYBNKXCDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c14-11(17)8-15-13(19)9-4-1-2-5-10(9)16-7-3-6-12(16)18/h1-2,4-5H,3,6-8H2,(H2,14,17)(H,15,19).
What are the key properties of N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide?
N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 261.28 g/mol, XLogP of 0.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 9297068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).