2-(1-methoxycyclobutyl)-1,3-thiazole

C8H11NOS — CID 58513745

IUPAC2-(1-methoxycyclobutyl)-1,3-thiazole
SMILESCOC1(c2nccs2)CCC1
InChIInChI=1S/C8H11NOS/c1-10-8(3-2-4-8)7-9-5-6-11-7/h5-6H,2-4H2,1H3
InChIKeyXNWMSUFSMFMXCM-UHFFFAOYSA-N
MW169.25 g/mol
LogP2.17
Rot. Bonds2

About 2-(1-methoxycyclobutyl)-1,3-thiazole

2-(1-methoxycyclobutyl)-1,3-thiazole (PubChem CID 58513745) has the molecular formula C8H11NOS and a molecular weight of 169.25 g/mol. Its IUPAC name is 2-(1-methoxycyclobutyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(1-methoxycyclobutyl)-1,3-thiazole
PubChem CID58513745
Molecular FormulaC8H11NOS
Molecular Weight169.25 g/mol
Exact Mass169.06
IUPAC Name2-(1-methoxycyclobutyl)-1,3-thiazole
SMILESCOC1(c2nccs2)CCC1
InChIInChI=1S/C8H11NOS/c1-10-8(3-2-4-8)7-9-5-6-11-7/h5-6H,2-4H2,1H3
InChIKeyXNWMSUFSMFMXCM-UHFFFAOYSA-N
XLogP2.17
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(1-methoxycyclobutyl)-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclobutyl)-1,3-thiazole?
The IUPAC name of 2-(1-methoxycyclobutyl)-1,3-thiazole (CID 58513745) is 2-(1-methoxycyclobutyl)-1,3-thiazole.
What is the SMILES notation for 2-(1-methoxycyclobutyl)-1,3-thiazole?
The canonical SMILES for 2-(1-methoxycyclobutyl)-1,3-thiazole is COC1(c2nccs2)CCC1.
What is the InChIKey of 2-(1-methoxycyclobutyl)-1,3-thiazole?
The InChIKey is XNWMSUFSMFMXCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NOS/c1-10-8(3-2-4-8)7-9-5-6-11-7/h5-6H,2-4H2,1H3.
What are the key properties of 2-(1-methoxycyclobutyl)-1,3-thiazole?
2-(1-methoxycyclobutyl)-1,3-thiazole has a molecular weight of 169.25 g/mol, XLogP of 2.17, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclobutyl)-1,3-thiazole is sourced from PubChem (CID 58513745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).