(2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide

C11H22N2O — CID 140912286

IUPAC(2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)[C@@H]1CCCN1CC(C)(C)C
InChIInChI=1S/C11H22N2O/c1-11(2,3)8-13-7-5-6-9(13)10(14)12-4/h9H,5-8H2,1-4H3,(H,12,14)/t9-/m0/s1
InChIKeyQDEIWWQJMRGEJB-VIFPVBQESA-N
MW198.31 g/mol
LogP1.24
Rot. Bonds2

About (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide

(2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide (PubChem CID 140912286) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide
PubChem CID140912286
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)[C@@H]1CCCN1CC(C)(C)C
InChIInChI=1S/C11H22N2O/c1-11(2,3)8-13-7-5-6-9(13)10(14)12-4/h9H,5-8H2,1-4H3,(H,12,14)/t9-/m0/s1
InChIKeyQDEIWWQJMRGEJB-VIFPVBQESA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-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

(2R)-1-(2,2-dimethylpropyl)pyrrolidine-2-carboxamide
CID 58877739
(2R)-N-methyl-1-propylpyrrolidine-2-carboxamide
CID 142459881
(2S)-1-(2,2-dimethylpropyl)piperidine-2-carboxylic acid
CID 139572604
1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide
CID 104750574
1-(2,2-dimethyl-3-sulfanylpropanoyl)-N-methylpyrrolidine-2-carboxamide
CID 163963935
1-but-3-ynyl-N-methylpiperidine-2-carboxamide
CID 63656435
1-(2-aminopropyl)-N-methylpiperidine-2-carboxamide
CID 102688966
1-[(4-fluorophenyl)methyl]-N-methylpyrrolidine-2-carboxamide
CID 47377078
1-[[5-(ethylamino)pyrazin-2-yl]methyl]-N-methylpyrrolidine-2-carboxamide
CID 103056191
1-[(6-chloropyridazin-3-yl)methyl]-N-methylpyrrolidine-2-carboxamide
CID 104513621
1-(2-amino-2-methylbutanoyl)-N-methylpyrrolidine-2-carboxamide
CID 79805766
1-[2-(2-hydroxyethoxy)ethyl]-N-methylpiperidine-2-carboxamide
CID 111439529

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide (CID 140912286) is (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide is CNC(=O)[C@@H]1CCCN1CC(C)(C)C.
What is the InChIKey of (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide?
The InChIKey is QDEIWWQJMRGEJB-VIFPVBQESA-N. The full InChI is InChI=1S/C11H22N2O/c1-11(2,3)8-13-7-5-6-9(13)10(14)12-4/h9H,5-8H2,1-4H3,(H,12,14)/t9-/m0/s1.
What are the key properties of (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide?
(2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide has a molecular weight of 198.31 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 140912286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).