1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol

C7H10N2OS — CID 67481659

IUPAC1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol
SMILESCN1CC(O)(c2nccs2)C1
InChIInChI=1S/C7H10N2OS/c1-9-4-7(10,5-9)6-8-2-3-11-6/h2-3,10H,4-5H2,1H3
InChIKeyALBRCIFYJNEDHN-UHFFFAOYSA-N
MW170.24 g/mol
LogP0.28
Rot. Bonds1

About 1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol

1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol (PubChem CID 67481659) has the molecular formula C7H10N2OS and a molecular weight of 170.24 g/mol. Its IUPAC name is 1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol.

Molecular Properties

Compound Name1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol
PubChem CID67481659
Molecular FormulaC7H10N2OS
Molecular Weight170.24 g/mol
Exact Mass170.05
IUPAC Name1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol
SMILESCN1CC(O)(c2nccs2)C1
InChIInChI=1S/C7H10N2OS/c1-9-4-7(10,5-9)6-8-2-3-11-6/h2-3,10H,4-5H2,1H3
InChIKeyALBRCIFYJNEDHN-UHFFFAOYSA-N
XLogP0.28
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.24
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-4-(1,3-thiazol-2-yl)cyclohexan-1-one
CID 59017437
4-tert-butyl-1-(1,3-thiazol-2-yl)cyclohexan-1-ol
CID 59743902
trans-(1S,4R)-4-hydroxy-1,2,2-trimethyl-4-(1,3-thiazol-2-yl)cyclohexane-1-carboxylic acid
CID 67430749
5-hydroxy-5-(1,3-thiazol-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylic acid
CID 71262303
2-(2-methyloxiran-2-yl)-1,3-thiazole
CID 45121806
6,7-difluoro-1-methoxy-3-(1,3-thiazol-2-yl)-2H-indol-3-ol
CID 102284034
2-(3-methyloxetan-3-yl)-1,3-thiazole
CID 58513727
6,7-difluoro-1-(2-hydroxyethyl)-3-(1,3-thiazol-2-yl)-2H-indol-3-ol
CID 102284035
trans-methyl (1R,4R)-4-hydroxy-2,2-dimethyl-4-(1,3-thiazol-2-yl)cyclohexane-1-carboxylate
CID 67432735
(4R)-1-tert-butyl-4-hydroxy-4-(1,3-thiazol-2-yl)azepan-1-ium-1-carboxylic acid
CID 67258770
methyl (1R,2R,4S)-4-hydroxy-2-methyl-4-(1,3-thiazol-2-yl)cyclohexane-1-carboxylate
CID 67431211
ethyl 1-formyl-4-hydroxy-4-(1,3-thiazol-2-yl)cyclohexane-1-carboxylate
CID 123371243

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol?
The IUPAC name of 1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol (CID 67481659) is 1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol.
What is the SMILES notation for 1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol?
The canonical SMILES for 1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol is CN1CC(O)(c2nccs2)C1.
What is the InChIKey of 1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol?
The InChIKey is ALBRCIFYJNEDHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2OS/c1-9-4-7(10,5-9)6-8-2-3-11-6/h2-3,10H,4-5H2,1H3.
What are the key properties of 1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol?
1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol has a molecular weight of 170.24 g/mol, XLogP of 0.28, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(1,3-thiazol-2-yl)azetidin-3-ol is sourced from PubChem (CID 67481659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).