2-(3-methylpyrrolidin-1-yl)ethanol

C7H15NO — CID 22706983

IUPAC2-(3-methylpyrrolidin-1-yl)ethanol
SMILESCC1CCN(CCO)C1
InChIInChI=1S/C7H15NO/c1-7-2-3-8(6-7)4-5-9/h7,9H,2-6H2,1H3
InChIKeyZOTVJESZONIGGS-UHFFFAOYSA-N
MW129.20 g/mol
LogP0.32
Rot. Bonds2

About 2-(3-methylpyrrolidin-1-yl)ethanol

2-(3-methylpyrrolidin-1-yl)ethanol (PubChem CID 22706983) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is 2-(3-methylpyrrolidin-1-yl)ethanol.

Molecular Properties

Compound Name2-(3-methylpyrrolidin-1-yl)ethanol
PubChem CID22706983
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name2-(3-methylpyrrolidin-1-yl)ethanol
SMILESCC1CCN(CCO)C1
InChIInChI=1S/C7H15NO/c1-7-2-3-8(6-7)4-5-9/h7,9H,2-6H2,1H3
InChIKeyZOTVJESZONIGGS-UHFFFAOYSA-N
XLogP0.32
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,5-dimethylpiperidin-1-yl)ethanol
CID 43394133
3-(3-methylpyrrolidin-1-yl)propane-1,2-diol
CID 23396961
(3S)-1-(2-hydroxyethyl)pyrrolidin-3-ol
CID 34177188
1-[2-(3-methylpyrrolidin-1-yl)ethyl]piperidin-4-amine
CID 79328360
2-amino-2-methyl-4-(3-methylpyrrolidin-1-yl)butan-1-ol
CID 64828070
1-[2-(3-methylpyrrolidin-1-yl)ethyl]cyclopropan-1-ol
CID 126995531
acetic acid;3-methyl-1-propylpyrrolidine
CID 175874786
1-(3-fluorobutyl)-3-methylpyrrolidine
CID 130660857
2-(3-methylsulfanylpyrrolidin-1-yl)ethanol
CID 131031599
ethane;1-ethyl-3-methylpyrrolidine
CID 90936593
CID 23403793
CID 23403793
1-(4-iodopent-4-enyl)-3-methylpyrrolidine
CID 155306683

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylpyrrolidin-1-yl)ethanol?
The IUPAC name of 2-(3-methylpyrrolidin-1-yl)ethanol (CID 22706983) is 2-(3-methylpyrrolidin-1-yl)ethanol.
What is the SMILES notation for 2-(3-methylpyrrolidin-1-yl)ethanol?
The canonical SMILES for 2-(3-methylpyrrolidin-1-yl)ethanol is CC1CCN(CCO)C1.
What is the InChIKey of 2-(3-methylpyrrolidin-1-yl)ethanol?
The InChIKey is ZOTVJESZONIGGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-7-2-3-8(6-7)4-5-9/h7,9H,2-6H2,1H3.
What are the key properties of 2-(3-methylpyrrolidin-1-yl)ethanol?
2-(3-methylpyrrolidin-1-yl)ethanol has a molecular weight of 129.20 g/mol, XLogP of 0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylpyrrolidin-1-yl)ethanol is sourced from PubChem (CID 22706983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).