[1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol

C9H19NO2 — CID 178025397

IUPAC[1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol
SMILESCCN1CCCC1(CO)COC
InChIInChI=1S/C9H19NO2/c1-3-10-6-4-5-9(10,7-11)8-12-2/h11H,3-8H2,1-2H3
InChIKeyLMSZZHICSPUCLR-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.48
Rot. Bonds4

About [1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol

[1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol (PubChem CID 178025397) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is [1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol
PubChem CID178025397
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name[1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol
SMILESCCN1CCCC1(CO)COC
InChIInChI=1S/C9H19NO2/c1-3-10-6-4-5-9(10,7-11)8-12-2/h11H,3-8H2,1-2H3
InChIKeyLMSZZHICSPUCLR-UHFFFAOYSA-N
XLogP0.48
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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-ethyl-2-(methoxymethyl)-2-(2-methylpropyl)pyrrolidine
CID 118615707
2-ethyl-2-(methoxymethyl)-1-methylpyrrolidine
CID 118615709
1,6-diethyl-1,6-diazaspiro[4.4]nonane
CID 89371000
2-[1-[2-(dimethylamino)-2-oxoethyl]-2-(methoxymethyl)pyrrolidin-2-yl]acetamide
CID 132962235
1,2,2-triethylpiperidine;hydrate
CID 175130909
ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol
CID 170726282
6-[(2R)-2-(methoxymethyl)-2-propylpyrrolidine-1-carbonyl]pyridine-2-carboxylic acid
CID 129470689
CID 101274523
CID 101274523
ethane;8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 168942817
[1-(cyclohex-3-en-1-ylmethyl)-2-ethylpyrrolidin-2-yl]methanol
CID 86806698
ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol
CID 172575983
2-(methoxymethyl)-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine
CID 176568360

Frequently Asked Questions

What is the IUPAC name of [1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol?
The IUPAC name of [1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol (CID 178025397) is [1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol is CCN1CCCC1(CO)COC.
What is the InChIKey of [1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol?
The InChIKey is LMSZZHICSPUCLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-3-10-6-4-5-9(10,7-11)8-12-2/h11H,3-8H2,1-2H3.
What are the key properties of [1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol?
[1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol has a molecular weight of 173.26 g/mol, XLogP of 0.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-ethyl-2-(methoxymethyl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 178025397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).