N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide

C12H22N2O2 — CID 63143850

IUPACN-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide
SMILESCOCCN(C(=O)C1(C)CCNC1)C1CC1
InChIInChI=1S/C12H22N2O2/c1-12(5-6-13-9-12)11(15)14(7-8-16-2)10-3-4-10/h10,13H,3-9H2,1-2H3
InChIKeyCHGJFUNJLHWUNE-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.62
Rot. Bonds5

About N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide

N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide (PubChem CID 63143850) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide
PubChem CID63143850
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide
SMILESCOCCN(C(=O)C1(C)CCNC1)C1CC1
InChIInChI=1S/C12H22N2O2/c1-12(5-6-13-9-12)11(15)14(7-8-16-2)10-3-4-10/h10,13H,3-9H2,1-2H3
InChIKeyCHGJFUNJLHWUNE-UHFFFAOYSA-N
XLogP0.62
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide (CID 63143850) is N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide is COCCN(C(=O)C1(C)CCNC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide?
The InChIKey is CHGJFUNJLHWUNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-12(5-6-13-9-12)11(15)14(7-8-16-2)10-3-4-10/h10,13H,3-9H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide?
N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63143850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).