2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol

C12H19NO2S — CID 106434859

IUPAC2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol
SMILESCC1CCC(CNCC(O)c2ccsc2)O1
InChIInChI=1S/C12H19NO2S/c1-9-2-3-11(15-9)6-13-7-12(14)10-4-5-16-8-10/h4-5,8-9,11-14H,2-3,6-7H2,1H3
InChIKeyFNBLWDKLTNIRJG-UHFFFAOYSA-N
MW241.36 g/mol
LogP1.94
Rot. Bonds5

About 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol

2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol (PubChem CID 106434859) has the molecular formula C12H19NO2S and a molecular weight of 241.36 g/mol. Its IUPAC name is 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol.

Molecular Properties

Compound Name2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol
PubChem CID106434859
Molecular FormulaC12H19NO2S
Molecular Weight241.36 g/mol
Exact Mass241.11
IUPAC Name2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol
SMILESCC1CCC(CNCC(O)c2ccsc2)O1
InChIInChI=1S/C12H19NO2S/c1-9-2-3-11(15-9)6-13-7-12(14)10-4-5-16-8-10/h4-5,8-9,11-14H,2-3,6-7H2,1H3
InChIKeyFNBLWDKLTNIRJG-UHFFFAOYSA-N
XLogP1.94
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol 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

2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-1-thiophen-3-ylethanol
CID 107095013
(2S)-1-[(2-hydroxy-2-thiophen-3-ylethyl)amino]propan-2-ol
CID 106435263
3-[(5-methyloxolan-2-yl)methylamino]propane-1,2-diol
CID 82835676
N-(cyclopentylmethyl)-2-thiophen-3-ylpropan-1-amine
CID 115907862
1-[(2-hydroxy-2-thiophen-3-ylethyl)amino]-3-methoxypropan-2-ol
CID 106435290
2-[(4-cyclopropylphenyl)methylamino]-1-thiophen-3-ylethanol
CID 106434767
2-(2-fluoroethylamino)-1-thiophen-3-ylethanol
CID 106435014
N-(cyclopropylmethyl)-2-[(2-hydroxy-2-thiophen-3-ylethyl)amino]acetamide
CID 106435169
N-cyclopropyl-2-[(2-hydroxy-2-thiophen-3-ylethyl)amino]acetamide
CID 106435052
1-cyclohexyloxy-3-[(2-hydroxy-2-thiophen-3-ylethyl)amino]propan-2-ol
CID 106435077
3-[(2-hydroxy-2-thiophen-3-ylethyl)amino]propan-1-ol
CID 106434996
3-methyl-N-[(5-methyloxolan-2-yl)methyl]-2-propan-2-ylbutan-1-amine
CID 102904444

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol?
The IUPAC name of 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol (CID 106434859) is 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol.
What is the SMILES notation for 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol?
The canonical SMILES for 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol is CC1CCC(CNCC(O)c2ccsc2)O1.
What is the InChIKey of 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol?
The InChIKey is FNBLWDKLTNIRJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2S/c1-9-2-3-11(15-9)6-13-7-12(14)10-4-5-16-8-10/h4-5,8-9,11-14H,2-3,6-7H2,1H3.
What are the key properties of 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol?
2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol has a molecular weight of 241.36 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methyloxolan-2-yl)methylamino]-1-thiophen-3-ylethanol is sourced from PubChem (CID 106434859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).