cycloheptyl(1,2-thiazol-5-yl)methanol

C11H17NOS — CID 130952207

IUPACcycloheptyl(1,2-thiazol-5-yl)methanol
SMILESOC(c1ccns1)C1CCCCCC1
InChIInChI=1S/C11H17NOS/c13-11(10-7-8-12-14-10)9-5-3-1-2-4-6-9/h7-9,11,13H,1-6H2
InChIKeyPYQDUOJMTHBPDU-UHFFFAOYSA-N
MW211.33 g/mol
LogP3.15
Rot. Bonds2

About cycloheptyl(1,2-thiazol-5-yl)methanol

cycloheptyl(1,2-thiazol-5-yl)methanol (PubChem CID 130952207) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is cycloheptyl(1,2-thiazol-5-yl)methanol.

Molecular Properties

Compound Namecycloheptyl(1,2-thiazol-5-yl)methanol
PubChem CID130952207
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Namecycloheptyl(1,2-thiazol-5-yl)methanol
SMILESOC(c1ccns1)C1CCCCCC1
InChIInChI=1S/C11H17NOS/c13-11(10-7-8-12-14-10)9-5-3-1-2-4-6-9/h7-9,11,13H,1-6H2
InChIKeyPYQDUOJMTHBPDU-UHFFFAOYSA-N
XLogP3.15
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,3-Difluorocyclopentyl)-(1,2-thiazol-5-yl)methanol
CID 130826100
2-(2,2-Difluoro-1-methylcyclopropyl)-1-(1,2-thiazol-5-yl)ethan-1-ol
CID 164652164
4,4-Difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
CID 164659228
4,4-Difluoro-1-(1,2-thiazol-5-yl)cyclohex-2-en-1-ol
CID 165497804
3-Cyclohexyl-1-(1,2-thiazol-5-yl)propan-1-ol
CID 59949219
3-Phenyl-1-(1,2-thiazol-5-yl)propan-1-ol
CID 71123420
4-Methyl-1-[2-(1,2-thiazol-5-yl)ethyl]cyclohex-2-en-1-ol
CID 155190878
3-(1,2-Thiazol-5-yl)butan-2-ol
CID 130801038
(3-Methoxyoxolan-3-yl)-(1,2-thiazol-5-yl)methanol
CID 130802936
2-Methyl-1-(1,2-thiazol-5-yl)cyclobutan-1-ol
CID 130826090
Cyclopentyl(1,2-thiazol-5-yl)methanol
CID 130826273
2-(1,2-Thiazol-5-yl)cyclohexan-1-ol
CID 130829137

Frequently Asked Questions

What is the IUPAC name of cycloheptyl(1,2-thiazol-5-yl)methanol?
The IUPAC name of cycloheptyl(1,2-thiazol-5-yl)methanol (CID 130952207) is cycloheptyl(1,2-thiazol-5-yl)methanol.
What is the SMILES notation for cycloheptyl(1,2-thiazol-5-yl)methanol?
The canonical SMILES for cycloheptyl(1,2-thiazol-5-yl)methanol is OC(c1ccns1)C1CCCCCC1.
What is the InChIKey of cycloheptyl(1,2-thiazol-5-yl)methanol?
The InChIKey is PYQDUOJMTHBPDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c13-11(10-7-8-12-14-10)9-5-3-1-2-4-6-9/h7-9,11,13H,1-6H2.
What are the key properties of cycloheptyl(1,2-thiazol-5-yl)methanol?
cycloheptyl(1,2-thiazol-5-yl)methanol has a molecular weight of 211.33 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cycloheptyl(1,2-thiazol-5-yl)methanol is sourced from PubChem (CID 130952207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).