N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide

C20H21N3O3 — CID 17487273

IUPACN-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide
SMILESO=C(CCNC(=O)c1ccccc1)Nc1cccc(N2CCCC2=O)c1
InChIInChI=1S/C20H21N3O3/c24-18(11-12-21-20(26)15-6-2-1-3-7-15)22-16-8-4-9-17(14-16)23-13-5-10-19(23)25/h1-4,6-9,14H,5,10-13H2,(H,21,26)(H,22,24)
InChIKeyDNQVYELLWVTUIN-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.57
Rot. Bonds6

About N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide

N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide (PubChem CID 17487273) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide.

Molecular Properties

Compound NameN-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide
PubChem CID17487273
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC NameN-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide
SMILESO=C(CCNC(=O)c1ccccc1)Nc1cccc(N2CCCC2=O)c1
InChIInChI=1S/C20H21N3O3/c24-18(11-12-21-20(26)15-6-2-1-3-7-15)22-16-8-4-9-17(14-16)23-13-5-10-19(23)25/h1-4,6-9,14H,5,10-13H2,(H,21,26)(H,22,24)
InChIKeyDNQVYELLWVTUIN-UHFFFAOYSA-N
XLogP2.57
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-benzamidoethyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 110309392
3-[2-oxo-2-[3-(2-oxopiperidin-1-yl)anilino]ethyl]benzoic acid
CID 120549405
3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-N-propylbenzamide
CID 55705699
4-(methylamino)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]butanamide;hydrochloride
CID 119692821
2,2-dimethyl-N-[4-oxo-4-[3-(2-oxopyrrolidin-1-yl)anilino]butyl]propanamide
CID 32756509
N-(2-benzamidoethyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 24659936
4-bromo-N-[3-oxo-3-[4-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide
CID 27838036
N-(2-hydroxyethyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 78816876
3-(2-oxopyrrolidin-1-yl)-N-[2-(phenylsulfamoyl)ethyl]benzamide
CID 110615723
N-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl]benzamide
CID 8745955
N-[3-(2-oxopyrrolidin-1-yl)phenyl]-3-(2-oxo-1,3-thiazolidin-3-yl)propanamide
CID 17423799
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 3-(2-oxopyrrolidin-1-yl)benzoate
CID 8729283

Frequently Asked Questions

What is the IUPAC name of N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide?
The IUPAC name of N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide (CID 17487273) is N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide.
What is the SMILES notation for N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide?
The canonical SMILES for N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide is O=C(CCNC(=O)c1ccccc1)Nc1cccc(N2CCCC2=O)c1.
What is the InChIKey of N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide?
The InChIKey is DNQVYELLWVTUIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c24-18(11-12-21-20(26)15-6-2-1-3-7-15)22-16-8-4-9-17(14-16)23-13-5-10-19(23)25/h1-4,6-9,14H,5,10-13H2,(H,21,26)(H,22,24).
What are the key properties of N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide?
N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide has a molecular weight of 351.41 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-oxo-3-[3-(2-oxopyrrolidin-1-yl)anilino]propyl]benzamide is sourced from PubChem (CID 17487273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).