[1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol

C10H21NO2 — CID 117017703

IUPAC[1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol
SMILESCOCCN1CCC(CO)C1(C)C
InChIInChI=1S/C10H21NO2/c1-10(2)9(8-12)4-5-11(10)6-7-13-3/h9,12H,4-8H2,1-3H3
InChIKeyADIHHGMPWJCIFG-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.73
Rot. Bonds4

About [1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol

[1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol (PubChem CID 117017703) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is [1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol
PubChem CID117017703
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name[1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol
SMILESCOCCN1CCC(CO)C1(C)C
InChIInChI=1S/C10H21NO2/c1-10(2)9(8-12)4-5-11(10)6-7-13-3/h9,12H,4-8H2,1-3H3
InChIKeyADIHHGMPWJCIFG-UHFFFAOYSA-N
XLogP0.73
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol
CID 117016800
1-(2-methoxyethyl)-2,2-dimethylpyrrolidine-3-carboxylic acid
CID 117017264
[1-(3-methoxypropyl)-2,2-dimethylpyrrolidin-3-yl]methanamine
CID 117017613
[2,2-dimethyl-1-(2-methylpropyl)pyrrolidin-3-yl]methanol
CID 117017699
1-(2-methoxyethyl)-N,2,2-trimethylpiperidin-3-amine
CID 117019270
[1-(3-methoxypropyl)-2,2-dimethylpiperidin-4-yl]methanol
CID 117020669
(1,2,2-trimethylpiperidin-3-yl)methanol
CID 117019756
1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol
CID 117019027
[1-(2-methoxyethyl)pyrrolidin-2-yl]methanol;sulfane
CID 159917406
2-(2,2-dimethyl-1-propylpyrrolidin-3-yl)acetic acid
CID 117017328
2-(1-butyl-2,2-dimethylpyrrolidin-3-yl)ethanamine
CID 117017535
2-(1,2,2-trimethylpyrrolidin-3-yl)ethanol
CID 117017383

Frequently Asked Questions

What is the IUPAC name of [1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol?
The IUPAC name of [1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol (CID 117017703) is [1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol?
The canonical SMILES for [1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol is COCCN1CCC(CO)C1(C)C.
What is the InChIKey of [1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol?
The InChIKey is ADIHHGMPWJCIFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-10(2)9(8-12)4-5-11(10)6-7-13-3/h9,12H,4-8H2,1-3H3.
What are the key properties of [1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol?
[1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol has a molecular weight of 187.28 g/mol, XLogP of 0.73, 4 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-yl]methanol is sourced from PubChem (CID 117017703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).