3-methoxy-3-methylpyrrolidine;hydrochloride

C6H14ClNO — CID 91663056

IUPAC3-methoxy-3-methylpyrrolidine;hydrochloride
SMILESCOC1(C)CCNC1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-6(8-2)3-4-7-5-6;/h7H,3-5H2,1-2H3;1H
InChIKeyIUQCGVWNWWKOLN-UHFFFAOYSA-N
MW151.64 g/mol
LogP0.81
Rot. Bonds1

About 3-methoxy-3-methylpyrrolidine;hydrochloride

3-methoxy-3-methylpyrrolidine;hydrochloride (PubChem CID 91663056) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is 3-methoxy-3-methylpyrrolidine;hydrochloride.

Molecular Properties

Compound Name3-methoxy-3-methylpyrrolidine;hydrochloride
PubChem CID91663056
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Name3-methoxy-3-methylpyrrolidine;hydrochloride
SMILESCOC1(C)CCNC1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-6(8-2)3-4-7-5-6;/h7H,3-5H2,1-2H3;1H
InChIKeyIUQCGVWNWWKOLN-UHFFFAOYSA-N
XLogP0.81
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-3-methylpyrrolidine;hydrochloride?
The IUPAC name of 3-methoxy-3-methylpyrrolidine;hydrochloride (CID 91663056) is 3-methoxy-3-methylpyrrolidine;hydrochloride.
What is the SMILES notation for 3-methoxy-3-methylpyrrolidine;hydrochloride?
The canonical SMILES for 3-methoxy-3-methylpyrrolidine;hydrochloride is COC1(C)CCNC1.Cl.
What is the InChIKey of 3-methoxy-3-methylpyrrolidine;hydrochloride?
The InChIKey is IUQCGVWNWWKOLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c1-6(8-2)3-4-7-5-6;/h7H,3-5H2,1-2H3;1H.
What are the key properties of 3-methoxy-3-methylpyrrolidine;hydrochloride?
3-methoxy-3-methylpyrrolidine;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-3-methylpyrrolidine;hydrochloride is sourced from PubChem (CID 91663056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).