2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide

C11H22N2O — CID 83080860

IUPAC2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide
SMILESCCC1(C(=O)N(C)C(C)C)CCCN1
InChIInChI=1S/C11H22N2O/c1-5-11(7-6-8-12-11)10(14)13(4)9(2)3/h9,12H,5-8H2,1-4H3
InChIKeyFYOASHGFKQCKRD-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.39
Rot. Bonds3

About 2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide

2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide (PubChem CID 83080860) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide
PubChem CID83080860
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide
SMILESCCC1(C(=O)N(C)C(C)C)CCCN1
InChIInChI=1S/C11H22N2O/c1-5-11(7-6-8-12-11)10(14)13(4)9(2)3/h9,12H,5-8H2,1-4H3
InChIKeyFYOASHGFKQCKRD-UHFFFAOYSA-N
XLogP1.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide?
The IUPAC name of 2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide (CID 83080860) is 2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for 2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide?
The canonical SMILES for 2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide is CCC1(C(=O)N(C)C(C)C)CCCN1.
What is the InChIKey of 2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide?
The InChIKey is FYOASHGFKQCKRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-5-11(7-6-8-12-11)10(14)13(4)9(2)3/h9,12H,5-8H2,1-4H3.
What are the key properties of 2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide?
2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide has a molecular weight of 198.31 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 83080860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).