N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide

C11H20N2O3 — CID 103933214

IUPACN-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide
SMILESCC(C)(O)C(C)(C)NC(=O)C1CCC(=O)N1
InChIInChI=1S/C11H20N2O3/c1-10(2,11(3,4)16)13-9(15)7-5-6-8(14)12-7/h7,16H,5-6H2,1-4H3,(H,12,14)(H,13,15)
InChIKeySHHHSXMQRGVRQG-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.07
Rot. Bonds3

About N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide

N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 103933214) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide
PubChem CID103933214
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide
SMILESCC(C)(O)C(C)(C)NC(=O)C1CCC(=O)N1
InChIInChI=1S/C11H20N2O3/c1-10(2,11(3,4)16)13-9(15)7-5-6-8(14)12-7/h7,16H,5-6H2,1-4H3,(H,12,14)(H,13,15)
InChIKeySHHHSXMQRGVRQG-UHFFFAOYSA-N
XLogP-0.07
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide
CID 103895358
2-methyl-2-[(5-oxopyrrolidine-2-carbonyl)amino]propanoic acid
CID 61261305
(2R)-N-(4-hydroxy-2-methylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide
CID 103874927
N-(1-amino-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide
CID 81487399
(2R)-N-[3-(hydroxymethyl)pentan-3-yl]-5-oxopyrrolidine-2-carboxamide
CID 103874900
(2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide
CID 103807490
N-[2-(4-chlorophenyl)propan-2-yl]-5-oxopyrrolidine-2-carboxamide
CID 110445231
(2S)-N-methyl-5-oxopyrrolidine-2-carboxamide;molecular hydrogen
CID 159147898
5-(2,2-dimethylpropanoyl)pyrrolidin-2-one
CID 76615275
(2S)-5-oxo-N-propan-2-ylpyrrolidine-2-carboxamide
CID 11105798
(2S)-N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 106188200
(2S)-3,3-dimethyl-2-[(5-oxopyrrolidine-2-carbonyl)amino]butanoic acid
CID 61144089

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide (CID 103933214) is N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide is CC(C)(O)C(C)(C)NC(=O)C1CCC(=O)N1.
What is the InChIKey of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is SHHHSXMQRGVRQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-10(2,11(3,4)16)13-9(15)7-5-6-8(14)12-7/h7,16H,5-6H2,1-4H3,(H,12,14)(H,13,15).
What are the key properties of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide?
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 228.29 g/mol, XLogP of -0.07, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 103933214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).