[6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol

C12H18N2O2 — CID 62239546

IUPAC[6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol
SMILESOCc1cccc(OCCN2CCCC2)n1
InChIInChI=1S/C12H18N2O2/c15-10-11-4-3-5-12(13-11)16-9-8-14-6-1-2-7-14/h3-5,15H,1-2,6-10H2
InChIKeyXFURJAFHLFDPBF-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.05
Rot. Bonds5

About [6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol

[6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol (PubChem CID 62239546) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is [6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol
PubChem CID62239546
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name[6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol
SMILESOCc1cccc(OCCN2CCCC2)n1
InChIInChI=1S/C12H18N2O2/c15-10-11-4-3-5-12(13-11)16-9-8-14-6-1-2-7-14/h3-5,15H,1-2,6-10H2
InChIKeyXFURJAFHLFDPBF-UHFFFAOYSA-N
XLogP1.05
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol?
The IUPAC name of [6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol (CID 62239546) is [6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol.
What is the SMILES notation for [6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol?
The canonical SMILES for [6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol is OCc1cccc(OCCN2CCCC2)n1.
What is the InChIKey of [6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol?
The InChIKey is XFURJAFHLFDPBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c15-10-11-4-3-5-12(13-11)16-9-8-14-6-1-2-7-14/h3-5,15H,1-2,6-10H2.
What are the key properties of [6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol?
[6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol has a molecular weight of 222.29 g/mol, XLogP of 1.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methanol is sourced from PubChem (CID 62239546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).