4-methoxy-1,2,2-trimethylpyrrolidine

C8H17NO — CID 59768170

IUPAC4-methoxy-1,2,2-trimethylpyrrolidine
SMILESCOC1CN(C)C(C)(C)C1
InChIInChI=1S/C8H17NO/c1-8(2)5-7(10-4)6-9(8)3/h7H,5-6H2,1-4H3
InChIKeyBCFVUJHKSFUEMZ-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.12
Rot. Bonds1

About 4-methoxy-1,2,2-trimethylpyrrolidine

4-methoxy-1,2,2-trimethylpyrrolidine (PubChem CID 59768170) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 4-methoxy-1,2,2-trimethylpyrrolidine.

Molecular Properties

Compound Name4-methoxy-1,2,2-trimethylpyrrolidine
PubChem CID59768170
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name4-methoxy-1,2,2-trimethylpyrrolidine
SMILESCOC1CN(C)C(C)(C)C1
InChIInChI=1S/C8H17NO/c1-8(2)5-7(10-4)6-9(8)3/h7H,5-6H2,1-4H3
InChIKeyBCFVUJHKSFUEMZ-UHFFFAOYSA-N
XLogP1.12
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1,2,2-trimethylpyrrolidine?
The IUPAC name of 4-methoxy-1,2,2-trimethylpyrrolidine (CID 59768170) is 4-methoxy-1,2,2-trimethylpyrrolidine.
What is the SMILES notation for 4-methoxy-1,2,2-trimethylpyrrolidine?
The canonical SMILES for 4-methoxy-1,2,2-trimethylpyrrolidine is COC1CN(C)C(C)(C)C1.
What is the InChIKey of 4-methoxy-1,2,2-trimethylpyrrolidine?
The InChIKey is BCFVUJHKSFUEMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-8(2)5-7(10-4)6-9(8)3/h7H,5-6H2,1-4H3.
What are the key properties of 4-methoxy-1,2,2-trimethylpyrrolidine?
4-methoxy-1,2,2-trimethylpyrrolidine has a molecular weight of 143.23 g/mol, XLogP of 1.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1,2,2-trimethylpyrrolidine is sourced from PubChem (CID 59768170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).