2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide

C16H19N3O3 — CID 167890277

IUPAC2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide
SMILESNC(=O)C1CCC1C(=O)Nc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C16H19N3O3/c17-15(21)12-7-8-13(12)16(22)18-10-3-5-11(6-4-10)19-9-1-2-14(19)20/h3-6,12-13H,1-2,7-9H2,(H2,17,21)(H,18,22)
InChIKeyJUEHJEOOHHLZSQ-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.26
Rot. Bonds4

About 2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide

2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide (PubChem CID 167890277) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is 2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide
PubChem CID167890277
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC Name2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide
SMILESNC(=O)C1CCC1C(=O)Nc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C16H19N3O3/c17-15(21)12-7-8-13(12)16(22)18-10-3-5-11(6-4-10)19-9-1-2-14(19)20/h3-6,12-13H,1-2,7-9H2,(H2,17,21)(H,18,22)
InChIKeyJUEHJEOOHHLZSQ-UHFFFAOYSA-N
XLogP1.26
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide
CID 7686385
9-amino-N-[4-(2-oxopyrrolidin-1-yl)phenyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120984328
N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 7686436
N-[4-(2-oxopyrrolidin-1-yl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119270698
(1R,2S,3R,4R)-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 98336597
4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 26127679
N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 30679166
3-[(1S,2R)-2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopentyl]benzamide
CID 12018193
tert-butyl 4-[[4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]piperidine-1-carboxylate
CID 36570789
1-amino-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclopropane-1-carboxamide;hydrochloride
CID 119688467
3-oxo-N-[4-(2-oxopyrrolidin-1-yl)phenyl]butanamide
CID 18072161
(2S)-2-amino-3,3-dimethyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]butanamide
CID 61155138

Frequently Asked Questions

What is the IUPAC name of 2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide?
The IUPAC name of 2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide (CID 167890277) is 2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide?
The canonical SMILES for 2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide is NC(=O)C1CCC1C(=O)Nc1ccc(N2CCCC2=O)cc1.
What is the InChIKey of 2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide?
The InChIKey is JUEHJEOOHHLZSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c17-15(21)12-7-8-13(12)16(22)18-10-3-5-11(6-4-10)19-9-1-2-14(19)20/h3-6,12-13H,1-2,7-9H2,(H2,17,21)(H,18,22).
What are the key properties of 2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide?
2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide has a molecular weight of 301.35 g/mol, XLogP of 1.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide is sourced from PubChem (CID 167890277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).