[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol

C13H19NO2 — CID 10751471

IUPAC[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
SMILESOCc1ccc(OCCN2CCCC2)cc1
InChIInChI=1S/C13H19NO2/c15-11-12-3-5-13(6-4-12)16-10-9-14-7-1-2-8-14/h3-6,15H,1-2,7-11H2
InChIKeyVQTVUGIHYCXTRL-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.65
Rot. Bonds5

About [4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol

[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol (PubChem CID 10751471) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is [4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol.

Molecular Properties

Compound Name[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
PubChem CID10751471
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
SMILESOCc1ccc(OCCN2CCCC2)cc1
InChIInChI=1S/C13H19NO2/c15-11-12-3-5-13(6-4-12)16-10-9-14-7-1-2-8-14/h3-6,15H,1-2,7-11H2
InChIKeyVQTVUGIHYCXTRL-UHFFFAOYSA-N
XLogP1.65
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[2-(azepan-1-yl)ethoxy]phenyl]methanol;hydrochloride
CID 78358370
1-[2-[4-(chloromethyl)phenoxy]ethyl]piperidine;1,2-dichloroethane;[4-(2-piperidin-1-ylethoxy)phenyl]methanol;thionyl dichloride
CID 159224641
2-(difluoromethyl)phenol;[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
CID 145415542
2-[4-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]piperazin-1-yl]ethanol
CID 110888313
1-[2-(4-ethylphenoxy)ethyl]piperidine
CID 867198
1-[2-(4-propylphenoxy)ethyl]pyrrolidine
CID 54244276
2-[2-hydroxyethyl-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]amino]ethanol
CID 10990902
1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
CID 803619
1-[4-[2-(azepan-1-yl)ethoxy]phenyl]propan-2-one
CID 70526687
1-[2-[4-(chloromethyl)phenoxy]ethyl]azetidine;hydrochloride
CID 175600849
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
2-[4-(hydroxymethyl)phenyl]sulfanyl-2-methyl-3-[4-(2-piperidin-1-ylethoxy)phenyl]propanoic acid
CID 71200590

Frequently Asked Questions

What is the IUPAC name of [4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol?
The IUPAC name of [4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol (CID 10751471) is [4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol.
What is the SMILES notation for [4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol?
The canonical SMILES for [4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol is OCc1ccc(OCCN2CCCC2)cc1.
What is the InChIKey of [4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol?
The InChIKey is VQTVUGIHYCXTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c15-11-12-3-5-13(6-4-12)16-10-9-14-7-1-2-8-14/h3-6,15H,1-2,7-11H2.
What are the key properties of [4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol?
[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol has a molecular weight of 221.30 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol is sourced from PubChem (CID 10751471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).