[4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol

C13H20N2O2 — CID 81238136

IUPAC[4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol
SMILESCN1CCCC1CCOc1ccncc1CO
InChIInChI=1S/C13H20N2O2/c1-15-7-2-3-12(15)5-8-17-13-4-6-14-9-11(13)10-16/h4,6,9,12,16H,2-3,5,7-8,10H2,1H3
InChIKeyLPGYBROXESHVIG-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.44
Rot. Bonds5

About [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol

[4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol (PubChem CID 81238136) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol
PubChem CID81238136
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name[4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol
SMILESCN1CCCC1CCOc1ccncc1CO
InChIInChI=1S/C13H20N2O2/c1-15-7-2-3-12(15)5-8-17-13-4-6-14-9-11(13)10-16/h4,6,9,12,16H,2-3,5,7-8,10H2,1H3
InChIKeyLPGYBROXESHVIG-UHFFFAOYSA-N
XLogP1.44
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methyl]cyclopropanamine
CID 81250859
N-[[4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methyl]propan-2-amine
CID 81251005
N-[[3-[2-(1-methylpyrrolidin-2-yl)ethoxy]-4-pyridinyl]methyl]ethanamine
CID 105075391
2-methyl-3-[2-[(2S)-1-methylpyrrolidin-2-yl]ethoxy]pyridine
CID 70084803
[4-[(1-methylpiperidin-2-yl)methoxy]-3-pyridinyl]methanamine
CID 81250968
1-methyl-2-[2-[4-methyl-2-[[5-methyl-2-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]methyl]phenoxy]ethyl]piperidine
CID 20738685
[6-[2-(1-methylpiperidin-2-yl)ethoxy]-1,3-benzodioxol-5-yl]methanol
CID 107912808
2-[2-[2-[2-(2-methoxyphenyl)ethyl]phenoxy]ethyl]-1-methylpyrrolidine
CID 10499737
1-methyl-2-[2-(2-methylphenoxy)ethyl]pyrrolidine
CID 23339324
6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyridine-3-carboxylic acid
CID 61101138
N-[[2-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]methyl]ethanamine
CID 107911038
N-[4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]-4-oxo-5,6,7,8-tetrahydro-1H-cyclohepta[b]pyrrole-3-carboxamide
CID 10222385

Frequently Asked Questions

What is the IUPAC name of [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol?
The IUPAC name of [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol (CID 81238136) is [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol.
What is the SMILES notation for [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol?
The canonical SMILES for [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol is CN1CCCC1CCOc1ccncc1CO.
What is the InChIKey of [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol?
The InChIKey is LPGYBROXESHVIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-15-7-2-3-12(15)5-8-17-13-4-6-14-9-11(13)10-16/h4,6,9,12,16H,2-3,5,7-8,10H2,1H3.
What are the key properties of [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol?
[4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol has a molecular weight of 236.31 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-3-pyridinyl]methanol is sourced from PubChem (CID 81238136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).