1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol

C10H16N2OS — CID 81467728

IUPAC1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol
SMILESCC1CC(O)(Cc2nccs2)CN1C
InChIInChI=1S/C10H16N2OS/c1-8-5-10(13,7-12(8)2)6-9-11-3-4-14-9/h3-4,8,13H,5-7H2,1-2H3
InChIKeyJALCHFYJQGAOPI-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.14
Rot. Bonds2

About 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol

1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol (PubChem CID 81467728) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol
PubChem CID81467728
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol
SMILESCC1CC(O)(Cc2nccs2)CN1C
InChIInChI=1S/C10H16N2OS/c1-8-5-10(13,7-12(8)2)6-9-11-3-4-14-9/h3-4,8,13H,5-7H2,1-2H3
InChIKeyJALCHFYJQGAOPI-UHFFFAOYSA-N
XLogP1.14
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol 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

(3R)-3,4,4-trimethyl-1-(1,3-thiazol-2-ylmethyl)-3-pyrrolidinol
CID 72916097
(3S,4S)-3-cyclobutyl-4-methyl-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol
CID 164629948
3-Amino-1,1,1-trifluoro-2-(1,3-thiazol-2-ylmethyl)pentan-2-ol
CID 79824631
6,6,6-Trifluoro-2-methyl-1-(1,3-thiazol-2-yl)hexan-2-ol
CID 116535922
1-(2-thiazolyl)Cyclohexanol
CID 12992811
2-Amino-4-methyl-1,1-bis(1,3-thiazol-2-yl)pentan-1-ol
CID 57165145
1-Methyl-4-(1,3-thiazol-2-yl)piperidin-4-ol
CID 59443948
(1-Methylpyrrolidin-3-yl)-(1,3-thiazol-2-yl)methanol
CID 60007100
(4R)-1-tert-butyl-4-hydroxy-4-(1,3-thiazol-2-yl)azepan-1-ium-1-carboxylate
CID 67258769
3-(1,3-Thiazol-2-yl)pentan-3-ol
CID 67259201
1-Methyl-3-(1,3-thiazol-2-yl)pyrrolidin-3-ol
CID 67481603
1-Methyl-2-(1,3-thiazol-2-yl)pyrrolidin-3-ol
CID 67481605

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol?
The IUPAC name of 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol (CID 81467728) is 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol.
What is the SMILES notation for 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol?
The canonical SMILES for 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol is CC1CC(O)(Cc2nccs2)CN1C.
What is the InChIKey of 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol?
The InChIKey is JALCHFYJQGAOPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-8-5-10(13,7-12(8)2)6-9-11-3-4-14-9/h3-4,8,13H,5-7H2,1-2H3.
What are the key properties of 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol?
1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol has a molecular weight of 212.32 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-ol is sourced from PubChem (CID 81467728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).