5-chloro-2-(oxolan-3-yl)-1,3-thiazole

C7H8ClNOS — CID 117259060

IUPAC5-chloro-2-(oxolan-3-yl)-1,3-thiazole
SMILESClc1cnc(C2CCOC2)s1
InChIInChI=1S/C7H8ClNOS/c8-6-3-9-7(11-6)5-1-2-10-4-5/h3,5H,1-2,4H2
InChIKeyWNCDCOSVABKAJI-UHFFFAOYSA-N
MW189.67 g/mol
LogP2.30
Rot. Bonds1

About 5-chloro-2-(oxolan-3-yl)-1,3-thiazole

5-chloro-2-(oxolan-3-yl)-1,3-thiazole (PubChem CID 117259060) has the molecular formula C7H8ClNOS and a molecular weight of 189.67 g/mol. Its IUPAC name is 5-chloro-2-(oxolan-3-yl)-1,3-thiazole.

Molecular Properties

Compound Name5-chloro-2-(oxolan-3-yl)-1,3-thiazole
PubChem CID117259060
Molecular FormulaC7H8ClNOS
Molecular Weight189.67 g/mol
Exact Mass189.00
IUPAC Name5-chloro-2-(oxolan-3-yl)-1,3-thiazole
SMILESClc1cnc(C2CCOC2)s1
InChIInChI=1S/C7H8ClNOS/c8-6-3-9-7(11-6)5-1-2-10-4-5/h3,5H,1-2,4H2
InChIKeyWNCDCOSVABKAJI-UHFFFAOYSA-N
XLogP2.30
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.67
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-(thiolan-3-yl)-1,3-thiazole
CID 117259063
5-[(3R)-oxolan-3-yl]-1,3-thiazol-2-amine
CID 124595055
5-(5-chloro-1,3-thiazol-2-yl)imidazolidine-2,4-dione
CID 107124200
5-[(3S)-oxolan-3-yl]-1,3-thiazol-2-amine
CID 124595056
5-[(3S)-oxolan-3-yl]-1,3,4-thiadiazol-2-amine
CID 94191622
7-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine
CID 132588404
N-[(5-chloro-1,3-thiazol-2-yl)methyl]-2-(oxolan-3-yl)ethanamine
CID 104879629
4-[4-[2-(oxolan-3-yl)-1,3-thiazol-5-yl]phenyl]-1,4-thiazinane 1-oxide
CID 166839620
N-[(2-cyclopropyl-1,3-thiazol-5-yl)methyl]oxolan-3-amine
CID 115757871
2-(oxan-4-yl)-5-pyridin-4-yl-1,3-thiazole
CID 141341183
6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine
CID 170726165
2-(oxolan-3-yl)-6,7-dihydro-1,3-benzothiazole
CID 167203629

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(oxolan-3-yl)-1,3-thiazole?
The IUPAC name of 5-chloro-2-(oxolan-3-yl)-1,3-thiazole (CID 117259060) is 5-chloro-2-(oxolan-3-yl)-1,3-thiazole.
What is the SMILES notation for 5-chloro-2-(oxolan-3-yl)-1,3-thiazole?
The canonical SMILES for 5-chloro-2-(oxolan-3-yl)-1,3-thiazole is Clc1cnc(C2CCOC2)s1.
What is the InChIKey of 5-chloro-2-(oxolan-3-yl)-1,3-thiazole?
The InChIKey is WNCDCOSVABKAJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNOS/c8-6-3-9-7(11-6)5-1-2-10-4-5/h3,5H,1-2,4H2.
What are the key properties of 5-chloro-2-(oxolan-3-yl)-1,3-thiazole?
5-chloro-2-(oxolan-3-yl)-1,3-thiazole has a molecular weight of 189.67 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(oxolan-3-yl)-1,3-thiazole is sourced from PubChem (CID 117259060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).