ethane;1-(2-methoxyethyl)-3-methylpyrrolidine

C10H23NO — CID 164877282

IUPACethane;1-(2-methoxyethyl)-3-methylpyrrolidine
SMILESCC.COCCN1CCC(C)C1
InChIInChI=1S/C8H17NO.C2H6/c1-8-3-4-9(7-8)5-6-10-2;1-2/h8H,3-7H2,1-2H3;1-2H3
InChIKeyQLNHHVFOYWPSTK-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.00
Rot. Bonds3

About ethane;1-(2-methoxyethyl)-3-methylpyrrolidine

ethane;1-(2-methoxyethyl)-3-methylpyrrolidine (PubChem CID 164877282) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is ethane;1-(2-methoxyethyl)-3-methylpyrrolidine.

Molecular Properties

Compound Nameethane;1-(2-methoxyethyl)-3-methylpyrrolidine
PubChem CID164877282
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Nameethane;1-(2-methoxyethyl)-3-methylpyrrolidine
SMILESCC.COCCN1CCC(C)C1
InChIInChI=1S/C8H17NO.C2H6/c1-8-3-4-9(7-8)5-6-10-2;1-2/h8H,3-7H2,1-2H3;1-2H3
InChIKeyQLNHHVFOYWPSTK-UHFFFAOYSA-N
XLogP2.00
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;1-(2-methoxyethyl)-3-methylpyrrolidine?
The IUPAC name of ethane;1-(2-methoxyethyl)-3-methylpyrrolidine (CID 164877282) is ethane;1-(2-methoxyethyl)-3-methylpyrrolidine.
What is the SMILES notation for ethane;1-(2-methoxyethyl)-3-methylpyrrolidine?
The canonical SMILES for ethane;1-(2-methoxyethyl)-3-methylpyrrolidine is CC.COCCN1CCC(C)C1.
What is the InChIKey of ethane;1-(2-methoxyethyl)-3-methylpyrrolidine?
The InChIKey is QLNHHVFOYWPSTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.C2H6/c1-8-3-4-9(7-8)5-6-10-2;1-2/h8H,3-7H2,1-2H3;1-2H3.
What are the key properties of ethane;1-(2-methoxyethyl)-3-methylpyrrolidine?
ethane;1-(2-methoxyethyl)-3-methylpyrrolidine has a molecular weight of 173.30 g/mol, XLogP of 2.00, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(2-methoxyethyl)-3-methylpyrrolidine is sourced from PubChem (CID 164877282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).