1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol

C9H19NO2 — CID 117016800

IUPAC1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol
SMILESCOCCN1CCC(O)C1(C)C
InChIInChI=1S/C9H19NO2/c1-9(2)8(11)4-5-10(9)6-7-12-3/h8,11H,4-7H2,1-3H3
InChIKeyNUUPMDBCNWYFDC-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.48
Rot. Bonds3

About 1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol

1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol (PubChem CID 117016800) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol.

Molecular Properties

Compound Name1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol
PubChem CID117016800
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol
SMILESCOCCN1CCC(O)C1(C)C
InChIInChI=1S/C9H19NO2/c1-9(2)8(11)4-5-10(9)6-7-12-3/h8,11H,4-7H2,1-3H3
InChIKeyNUUPMDBCNWYFDC-UHFFFAOYSA-N
XLogP0.48
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol
CID 117019027
[1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol
CID 117017703
1-(2-methoxyethyl)-2,2-dimethylpyrrolidine-3-carboxylic acid
CID 117017264
1-(2-methoxyethyl)-N,2,2-trimethylpiperidin-3-amine
CID 117019270
[1-(3-methoxypropyl)-2,2-dimethylpyrrolidin-3-yl]methanamine
CID 117017613
1-[2-(aminomethyl)prop-2-enyl]-2,2-dimethylpyrrolidin-3-ol
CID 131114201
2-[1-(2-methoxyethyl)-2,2-dimethylpiperidin-4-yl]acetonitrile
CID 117020474
1-(2-methoxyethyl)-3,3,7-trimethyl-1,4-diazepane
CID 64869408
1-[[1-(bromomethyl)cyclobutyl]methyl]-2,2-dimethylpyrrolidin-3-ol
CID 131067156
(3R,5S)-1-(2-methoxyethyl)-5-methylpyrrolidin-3-ol
CID 99995143
1-(2-methoxyethyl)-6,6-dimethylpiperidine-3-carboxylic acid
CID 117021222
[1-(3-methoxypropyl)-2,2-dimethylpiperidin-4-yl]methanol
CID 117020669

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol?
The IUPAC name of 1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol (CID 117016800) is 1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol.
What is the SMILES notation for 1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol?
The canonical SMILES for 1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol is COCCN1CCC(O)C1(C)C.
What is the InChIKey of 1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol?
The InChIKey is NUUPMDBCNWYFDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-9(2)8(11)4-5-10(9)6-7-12-3/h8,11H,4-7H2,1-3H3.
What are the key properties of 1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol?
1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol has a molecular weight of 173.26 g/mol, XLogP of 0.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol is sourced from PubChem (CID 117016800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).