(2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide

C12H22N2O3 — CID 103941043

IUPAC(2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide
SMILESCC(C)(C)C(CCO)NC(=O)[C@H]1CCC(=O)N1
InChIInChI=1S/C12H22N2O3/c1-12(2,3)9(6-7-15)14-11(17)8-4-5-10(16)13-8/h8-9,15H,4-7H2,1-3H3,(H,13,16)(H,14,17)/t8-,9?/m1/s1
InChIKeyXBZVTMFOAFDOHS-VEDVMXKPSA-N
MW242.32 g/mol
LogP0.18
Rot. Bonds4

About (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide

(2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 103941043) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide
PubChem CID103941043
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Name(2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide
SMILESCC(C)(C)C(CCO)NC(=O)[C@H]1CCC(=O)N1
InChIInChI=1S/C12H22N2O3/c1-12(2,3)9(6-7-15)14-11(17)8-4-5-10(16)13-8/h8-9,15H,4-7H2,1-3H3,(H,13,16)(H,14,17)/t8-,9?/m1/s1
InChIKeyXBZVTMFOAFDOHS-VEDVMXKPSA-N
XLogP0.18
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-3,3-dimethyl-2-[(5-oxopyrrolidine-2-carbonyl)amino]butanoic acid
CID 61144089
(2S)-5-oxo-N-propan-2-ylpyrrolidine-2-carboxamide
CID 11105798
(2R)-N-(4-hydroxy-2-methylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide
CID 103874927
N-(1-hydroxybutan-2-yl)-5-oxopyrrolidine-2-carboxamide
CID 43500469
N-(6-aminohexan-2-yl)-5-oxopyrrolidine-2-carboxamide
CID 59525111
N-(1-hydroxy-4,4-dimethylpentan-3-yl)cycloheptanecarboxamide
CID 106353098
tert-butyl (2S)-3-methyl-2-[[(2R)-5-oxopyrrolidine-2-carbonyl]amino]butanoate
CID 103762213
N-(1-hydroxy-4,4-dimethylpentan-3-yl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide
CID 106349918
(2R)-N-[(2R)-1-aminopropan-2-yl]-5-oxopyrrolidine-2-carboxamide
CID 104872886
3-methyl-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]butanoate
CID 131841435
(2R)-5-oxo-N-pent-4-yn-2-ylpyrrolidine-2-carboxamide
CID 103709621
(2S)-5-[(2-methylpropan-2-yl)oxy]-5-oxo-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]pentanoic acid
CID 71407874

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide (CID 103941043) is (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide is CC(C)(C)C(CCO)NC(=O)[C@H]1CCC(=O)N1.
What is the InChIKey of (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is XBZVTMFOAFDOHS-VEDVMXKPSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-12(2,3)9(6-7-15)14-11(17)8-4-5-10(16)13-8/h8-9,15H,4-7H2,1-3H3,(H,13,16)(H,14,17)/t8-,9?/m1/s1.
What are the key properties of (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide?
(2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 242.32 g/mol, XLogP of 0.18, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 103941043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).