[4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol

C16H20N2O2S — CID 10828365

IUPAC[4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol
SMILESOC(c1ccc(OCCN2CCCC2)cc1)c1cncs1
InChIInChI=1S/C16H20N2O2S/c19-16(15-11-17-12-21-15)13-3-5-14(6-4-13)20-10-9-18-7-1-2-8-18/h3-6,11-12,16,19H,1-2,7-10H2
InChIKeySOODEVHYMZXQEH-UHFFFAOYSA-N
MW304.42 g/mol
LogP2.70
Rot. Bonds6

About [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol

[4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol (PubChem CID 10828365) has the molecular formula C16H20N2O2S and a molecular weight of 304.42 g/mol. Its IUPAC name is [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol.

Molecular Properties

Compound Name[4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol
PubChem CID10828365
Molecular FormulaC16H20N2O2S
Molecular Weight304.42 g/mol
Exact Mass304.12
IUPAC Name[4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol
SMILESOC(c1ccc(OCCN2CCCC2)cc1)c1cncs1
InChIInChI=1S/C16H20N2O2S/c19-16(15-11-17-12-21-15)13-3-5-14(6-4-13)20-10-9-18-7-1-2-8-18/h3-6,11-12,16,19H,1-2,7-10H2
InChIKeySOODEVHYMZXQEH-UHFFFAOYSA-N
XLogP2.70
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)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

(4-chlorophenyl)-[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
CID 23553296
(1S)-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-1-ol
CID 78933445
2-hydroxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide
CID 139930605
(2S)-2-amino-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol
CID 66515465
4-[hydroxy(1,3-thiazol-5-yl)methyl]benzonitrile
CID 18949024
CID 161147503
CID 161147503
5-(2-pyrrolidin-1-ylethoxy)pyridine-2-carboxylic acid
CID 79793888
(1S)-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-1-amine
CID 78937096
[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
CID 10751471
1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
CID 803619
1-[4-(5-pyrrolidin-1-ylpentoxy)phenyl]ethanol
CID 11857382
1-[2-[4-[(2-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]azepane
CID 71503020

Frequently Asked Questions

What is the IUPAC name of [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol?
The IUPAC name of [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol (CID 10828365) is [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol.
What is the SMILES notation for [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol?
The canonical SMILES for [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol is OC(c1ccc(OCCN2CCCC2)cc1)c1cncs1.
What is the InChIKey of [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol?
The InChIKey is SOODEVHYMZXQEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S/c19-16(15-11-17-12-21-15)13-3-5-14(6-4-13)20-10-9-18-7-1-2-8-18/h3-6,11-12,16,19H,1-2,7-10H2.
What are the key properties of [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol?
[4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol has a molecular weight of 304.42 g/mol, XLogP of 2.70, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-pyrrolidin-1-ylethoxy)phenyl]-(1,3-thiazol-5-yl)methanol is sourced from PubChem (CID 10828365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).