(3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol

C9H14N2O2S — CID 130673824

IUPAC(3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol
SMILESCOc1cc(C(O)C2CCCN2)sn1
InChIInChI=1S/C9H14N2O2S/c1-13-8-5-7(14-11-8)9(12)6-3-2-4-10-6/h5-6,9-10,12H,2-4H2,1H3
InChIKeyYRDCGMIBPXMUQJ-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.94
Rot. Bonds3

About (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol

(3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol (PubChem CID 130673824) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol.

Molecular Properties

Compound Name(3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol
PubChem CID130673824
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC Name(3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol
SMILESCOc1cc(C(O)C2CCCN2)sn1
InChIInChI=1S/C9H14N2O2S/c1-13-8-5-7(14-11-8)9(12)6-3-2-4-10-6/h5-6,9-10,12H,2-4H2,1H3
InChIKeyYRDCGMIBPXMUQJ-UHFFFAOYSA-N
XLogP0.94
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol 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

cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol
CID 130748192
(S)-(3,5-dimethoxyphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 135313109
1-(3-methoxy-1,2-thiazol-5-yl)-2-methylpropane-1,2-diol
CID 130748198
(4,5-dibromothiophen-2-yl)-pyrrolidin-2-ylmethanol
CID 80535555
(2-methoxy-1,3-thiazol-4-yl)-pyrrolidin-2-ylmethanol
CID 126982766
ethane;(4-methoxyphenyl)-pyrrolidin-2-ylmethanol
CID 142507524
1-(3-methoxy-1,2-thiazol-5-yl)but-3-yn-1-ol
CID 131036535
(2-methoxy-5-methylphenyl)-pyrrolidin-2-ylmethanol
CID 64866825
1-pyrrolidin-2-ylpropan-1-ol;hydrochloride
CID 172641162
(3-methoxyphenyl)-[(2S)-piperidin-2-yl]methanol
CID 69187424
phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride
CID 68687169
(2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol
CID 82341661

Frequently Asked Questions

What is the IUPAC name of (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol?
The IUPAC name of (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol (CID 130673824) is (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol.
What is the SMILES notation for (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol?
The canonical SMILES for (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol is COc1cc(C(O)C2CCCN2)sn1.
What is the InChIKey of (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol?
The InChIKey is YRDCGMIBPXMUQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c1-13-8-5-7(14-11-8)9(12)6-3-2-4-10-6/h5-6,9-10,12H,2-4H2,1H3.
What are the key properties of (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol?
(3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol has a molecular weight of 214.29 g/mol, XLogP of 0.94, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol is sourced from PubChem (CID 130673824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).