(2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide

C7H12N2O2 — CID 170454186

IUPAC(2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide
SMILESCN(C)C(=O)[C@@H]1CC(=O)CN1
InChIInChI=1S/C7H12N2O2/c1-9(2)7(11)6-3-5(10)4-8-6/h6,8H,3-4H2,1-2H3/t6-/m0/s1
InChIKeyAYGCEKHXGHNDLR-LURJTMIESA-N
MW156.19 g/mol
LogP-0.99
Rot. Bonds1

About (2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide

(2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide (PubChem CID 170454186) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is (2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide
PubChem CID170454186
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC Name(2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide
SMILESCN(C)C(=O)[C@@H]1CC(=O)CN1
InChIInChI=1S/C7H12N2O2/c1-9(2)7(11)6-3-5(10)4-8-6/h6,8H,3-4H2,1-2H3/t6-/m0/s1
InChIKeyAYGCEKHXGHNDLR-LURJTMIESA-N
XLogP-0.99
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide (CID 170454186) is (2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide is CN(C)C(=O)[C@@H]1CC(=O)CN1.
What is the InChIKey of (2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide?
The InChIKey is AYGCEKHXGHNDLR-LURJTMIESA-N. The full InChI is InChI=1S/C7H12N2O2/c1-9(2)7(11)6-3-5(10)4-8-6/h6,8H,3-4H2,1-2H3/t6-/m0/s1.
What are the key properties of (2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide?
(2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide has a molecular weight of 156.19 g/mol, XLogP of -0.99, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N,N-dimethyl-4-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 170454186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).