N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide

C15H20N2O2 — CID 78981915

IUPACN-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)C1CNC(=O)C1
InChIInChI=1S/C15H20N2O2/c1-3-10-6-5-7-11(4-2)14(10)17-15(19)12-8-13(18)16-9-12/h5-7,12H,3-4,8-9H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyZBFGRIJRBPRESH-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.89
Rot. Bonds4

About N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide

N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 78981915) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID78981915
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)C1CNC(=O)C1
InChIInChI=1S/C15H20N2O2/c1-3-10-6-5-7-11(4-2)14(10)17-15(19)12-8-13(18)16-9-12/h5-7,12H,3-4,8-9H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyZBFGRIJRBPRESH-UHFFFAOYSA-N
XLogP1.89
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-diethylphenyl)cyclopropanecarboxamide
CID 5238371
N-(2,6-diethylphenyl)-5-oxopiperazine-2-carboxamide
CID 107433398
N-(2,6-diethylphenyl)-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 113186319
N-[4-(cyclopropanecarbonylamino)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 78982525
5-oxo-N-(2,4,6-trichlorophenyl)pyrrolidine-3-carboxamide
CID 83192640
N-(2,6-diethylphenyl)-5-methylpiperazine-2-carboxamide
CID 63102745
5-oxo-N-(3-phenylphenyl)pyrrolidine-3-carboxamide
CID 136542533
N-(2-fluoro-6-nitrophenyl)-5-oxopyrrolidine-3-carboxamide
CID 83192750
N-(2,6-diethylphenyl)-5-oxomorpholine-3-carboxamide
CID 110696796
N-[2-(dimethylamino)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 78981788
N-(2,6-diethylphenyl)-1-ethylsulfonylpiperidine-4-carboxamide
CID 17027123
N-(2,6-diethylphenyl)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide
CID 113182868

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide (CID 78981915) is N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide is CCc1cccc(CC)c1NC(=O)C1CNC(=O)C1.
What is the InChIKey of N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is ZBFGRIJRBPRESH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-3-10-6-5-7-11(4-2)14(10)17-15(19)12-8-13(18)16-9-12/h5-7,12H,3-4,8-9H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide?
N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 78981915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).