(2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen

C9H22N2O — CID 143691974

IUPAC(2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen
SMILESCC.CN(C)C(=O)[C@@H]1CCCN1.[H][H]
InChIInChI=1S/C7H14N2O.C2H6.H2/c1-9(2)7(10)6-4-3-5-8-6;1-2;/h6,8H,3-5H2,1-2H3;1-2H3;1H/t6-;;/m0../s1
InChIKeyKFBFNZITQGNEIL-ILKKLZGPSA-N
MW174.29 g/mol
LogP1.10
Rot. Bonds1

About (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen

(2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen (PubChem CID 143691974) has the molecular formula C9H22N2O and a molecular weight of 174.29 g/mol. Its IUPAC name is (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen.

Molecular Properties

Compound Name(2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen
PubChem CID143691974
Molecular FormulaC9H22N2O
Molecular Weight174.29 g/mol
Exact Mass174.17
IUPAC Name(2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen
SMILESCC.CN(C)C(=O)[C@@H]1CCCN1.[H][H]
InChIInChI=1S/C7H14N2O.C2H6.H2/c1-9(2)7(10)6-4-3-5-8-6;1-2;/h6,8H,3-5H2,1-2H3;1-2H3;1H/t6-;;/m0../s1
InChIKeyKFBFNZITQGNEIL-ILKKLZGPSA-N
XLogP1.10
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.29
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen 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)-N,N-dimethylpyrrolidine-2-carboxamide;molecular hydrogen
CID 143692131
N,N-dimethylpyrrolidine-2-carboxamide
CID 14282308
(2R)-N,N-dimethylazetidine-2-carboxamide
CID 124537269
(2S)-N-cyclohexyl-N-methylpyrrolidine-2-carboxamide
CID 23520170
(2R)-N,N-diethylpyrrolidine-2-carboxamide
CID 952316
(2R)-N-[2-(dimethylamino)ethyl]-N-methylpyrrolidine-2-carboxamide
CID 89362128
(2S)-N-methyl-N-propylpyrrolidine-2-carboxamide
CID 54558702
(2R)-N-methyl-N-[2-(methylamino)ethyl]pyrrolidine-2-carboxamide
CID 103885144
N,N-dimethyl-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide
CID 43579479
(2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide
CID 93224848
(2R)-N-tert-butyl-N-methylpiperidine-2-carboxamide
CID 130877800
N-methyl-N-phenylpyrrolidine-2-carboxamide
CID 550989

Frequently Asked Questions

What is the IUPAC name of (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen?
The IUPAC name of (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen (CID 143691974) is (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen.
What is the SMILES notation for (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen?
The canonical SMILES for (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen is CC.CN(C)C(=O)[C@@H]1CCCN1.[H][H].
What is the InChIKey of (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen?
The InChIKey is KFBFNZITQGNEIL-ILKKLZGPSA-N. The full InChI is InChI=1S/C7H14N2O.C2H6.H2/c1-9(2)7(10)6-4-3-5-8-6;1-2;/h6,8H,3-5H2,1-2H3;1-2H3;1H/t6-;;/m0../s1.
What are the key properties of (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen?
(2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen has a molecular weight of 174.29 g/mol, XLogP of 1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N,N-dimethylpyrrolidine-2-carboxamide;ethane;molecular hydrogen is sourced from PubChem (CID 143691974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).