(3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine

C11H24N2O — CID 166870119

IUPAC(3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine
SMILESCCN1C[C@H](NCCOC)CC1(C)C
InChIInChI=1S/C11H24N2O/c1-5-13-9-10(8-11(13,2)3)12-6-7-14-4/h10,12H,5-9H2,1-4H3/t10-/m1/s1
InChIKeyHDUSJMMBSNBIIG-SNVBAGLBSA-N
MW200.33 g/mol
LogP1.10
Rot. Bonds5

About (3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine

(3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine (PubChem CID 166870119) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is (3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine
PubChem CID166870119
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name(3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine
SMILESCCN1C[C@H](NCCOC)CC1(C)C
InChIInChI=1S/C11H24N2O/c1-5-13-9-10(8-11(13,2)3)12-6-7-14-4/h10,12H,5-9H2,1-4H3/t10-/m1/s1
InChIKeyHDUSJMMBSNBIIG-SNVBAGLBSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine?
The IUPAC name of (3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine (CID 166870119) is (3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine.
What is the SMILES notation for (3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine?
The canonical SMILES for (3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine is CCN1C[C@H](NCCOC)CC1(C)C.
What is the InChIKey of (3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine?
The InChIKey is HDUSJMMBSNBIIG-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H24N2O/c1-5-13-9-10(8-11(13,2)3)12-6-7-14-4/h10,12H,5-9H2,1-4H3/t10-/m1/s1.
What are the key properties of (3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine?
(3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine has a molecular weight of 200.33 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-ethyl-N-(2-methoxyethyl)-5,5-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 166870119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).