2-(2-pyrrolidin-1-ylethoxy)ethanol

C8H17NO2 — CID 10080651

IUPAC2-(2-pyrrolidin-1-ylethoxy)ethanol
SMILESOCCOCCN1CCCC1
InChIInChI=1S/C8H17NO2/c10-6-8-11-7-5-9-3-1-2-4-9/h10H,1-8H2
InChIKeyKWLQXGKYBGCUTP-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.09
Rot. Bonds5

About 2-(2-pyrrolidin-1-ylethoxy)ethanol

2-(2-pyrrolidin-1-ylethoxy)ethanol (PubChem CID 10080651) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 2-(2-pyrrolidin-1-ylethoxy)ethanol.

Molecular Properties

Compound Name2-(2-pyrrolidin-1-ylethoxy)ethanol
PubChem CID10080651
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name2-(2-pyrrolidin-1-ylethoxy)ethanol
SMILESOCCOCCN1CCCC1
InChIInChI=1S/C8H17NO2/c10-6-8-11-7-5-9-3-1-2-4-9/h10H,1-8H2
InChIKeyKWLQXGKYBGCUTP-UHFFFAOYSA-N
XLogP0.09
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-[2-[methyl-[2-(2-pyrrolidin-1-ylethoxy)ethyl]amino]ethoxy]ethoxy]ethanol
CID 118891602
2-[2-[4-(3-aminopropyl)piperazin-1-yl]ethoxy]ethanol
CID 61070861
1-[2-(2-hydroxyethoxy)ethyl]piperidine-3-carboxylic acid
CID 61070324
2-[2-[3-(azepan-1-yl)piperidin-1-yl]ethoxy]ethanol
CID 111439692
2-[2-[2-[2-[methyl(2-pyrrolidin-1-ylethyl)amino]ethoxy]ethoxy]ethoxy]ethanol
CID 118891601
2-[4,7-bis(carboxymethyl)-10-[2-(2-hydroxyethoxy)ethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 19438545
2-[2-[4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl]ethoxy]acetic acid
CID 176958923
2-[2-[4-(dimethylamino)piperidin-1-yl]ethoxy]ethanol
CID 61069984
ethane;2-[2-(4-pentylpiperazin-1-yl)ethoxy]ethanol;tungsten
CID 156720121
2-[2-(4-methylsulfonylpiperazin-1-yl)ethoxy]ethanol
CID 62994663
1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol
CID 103684371
2-(2-pyrrolidin-1-ylethoxy)-N-[2-[2-(2-pyrrolidin-1-ylethoxy)ethoxy]ethyl]ethanamine
CID 118891597

Frequently Asked Questions

What is the IUPAC name of 2-(2-pyrrolidin-1-ylethoxy)ethanol?
The IUPAC name of 2-(2-pyrrolidin-1-ylethoxy)ethanol (CID 10080651) is 2-(2-pyrrolidin-1-ylethoxy)ethanol.
What is the SMILES notation for 2-(2-pyrrolidin-1-ylethoxy)ethanol?
The canonical SMILES for 2-(2-pyrrolidin-1-ylethoxy)ethanol is OCCOCCN1CCCC1.
What is the InChIKey of 2-(2-pyrrolidin-1-ylethoxy)ethanol?
The InChIKey is KWLQXGKYBGCUTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c10-6-8-11-7-5-9-3-1-2-4-9/h10H,1-8H2.
What are the key properties of 2-(2-pyrrolidin-1-ylethoxy)ethanol?
2-(2-pyrrolidin-1-ylethoxy)ethanol has a molecular weight of 159.23 g/mol, XLogP of 0.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyrrolidin-1-ylethoxy)ethanol is sourced from PubChem (CID 10080651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).