(2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide

C14H18N2O3 — CID 28740149

IUPAC(2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide
SMILESCCN(C(=O)[C@H]1CCC(=O)N1)c1cc(O)ccc1C
InChIInChI=1S/C14H18N2O3/c1-3-16(12-8-10(17)5-4-9(12)2)14(19)11-6-7-13(18)15-11/h4-5,8,11,17H,3,6-7H2,1-2H3,(H,15,18)/t11-/m1/s1
InChIKeyUKFDHKFOOJGXOA-LLVKDONJSA-N
MW262.31 g/mol
LogP1.33
Rot. Bonds3

About (2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide

(2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 28740149) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is (2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide
PubChem CID28740149
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name(2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide
SMILESCCN(C(=O)[C@H]1CCC(=O)N1)c1cc(O)ccc1C
InChIInChI=1S/C14H18N2O3/c1-3-16(12-8-10(17)5-4-9(12)2)14(19)11-6-7-13(18)15-11/h4-5,8,11,17H,3,6-7H2,1-2H3,(H,15,18)/t11-/m1/s1
InChIKeyUKFDHKFOOJGXOA-LLVKDONJSA-N
XLogP1.33
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(5-hydroxy-2-methylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66477100
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 107179782
N-ethyl-N-(5-hydroxy-2-methylphenyl)-7-azabicyclo[2.2.1]heptane-2-carboxamide
CID 107734506
(2S)-N-(4-hydroxyphenyl)-N-methyl-5-oxopyrrolidine-2-carboxamide
CID 28739228
N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-iodobenzamide
CID 28978793
N-ethyl-N-(5-hydroxy-2-methylphenyl)-3-pyrrolidin-3-ylpropanamide
CID 107734533
N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide
CID 102922038
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-(propan-2-ylamino)acetamide
CID 107734471
N-ethyl-N-(5-hydroxy-2-methylphenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 104772781
N-ethyl-N-(5-hydroxy-2-methylphenyl)-3-piperidin-3-ylpropanamide
CID 107734491
2-(1,4-diazepan-1-yl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)acetamide
CID 107734552
2-(cyclohexen-1-yl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)acetamide
CID 63564415

Frequently Asked Questions

What is the IUPAC name of (2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide (CID 28740149) is (2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide is CCN(C(=O)[C@H]1CCC(=O)N1)c1cc(O)ccc1C.
What is the InChIKey of (2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is UKFDHKFOOJGXOA-LLVKDONJSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-3-16(12-8-10(17)5-4-9(12)2)14(19)11-6-7-13(18)15-11/h4-5,8,11,17H,3,6-7H2,1-2H3,(H,15,18)/t11-/m1/s1.
What are the key properties of (2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide?
(2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 1.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 28740149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).