methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine

C10H14N2S — CID 160984221

IUPACmethane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine
SMILESC.CC(C)c1nc2cccnc2s1
InChIInChI=1S/C9H10N2S.CH4/c1-6(2)8-11-7-4-3-5-10-9(7)12-8;/h3-6H,1-2H3;1H4
InChIKeySZXHOTSMRQTOCP-UHFFFAOYSA-N
MW194.30 g/mol
LogP3.45
Rot. Bonds1

About methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine

methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine (PubChem CID 160984221) has the molecular formula C10H14N2S and a molecular weight of 194.30 g/mol. Its IUPAC name is methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine.

Molecular Properties

Compound Namemethane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine
PubChem CID160984221
Molecular FormulaC10H14N2S
Molecular Weight194.30 g/mol
Exact Mass194.09
IUPAC Namemethane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine
SMILESC.CC(C)c1nc2cccnc2s1
InChIInChI=1S/C9H10N2S.CH4/c1-6(2)8-11-7-4-3-5-10-9(7)12-8;/h3-6H,1-2H3;1H4
InChIKeySZXHOTSMRQTOCP-UHFFFAOYSA-N
XLogP3.45
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine?
The IUPAC name of methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine (CID 160984221) is methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine.
What is the SMILES notation for methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine?
The canonical SMILES for methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine is C.CC(C)c1nc2cccnc2s1.
What is the InChIKey of methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine?
The InChIKey is SZXHOTSMRQTOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2S.CH4/c1-6(2)8-11-7-4-3-5-10-9(7)12-8;/h3-6H,1-2H3;1H4.
What are the key properties of methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine?
methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine has a molecular weight of 194.30 g/mol, XLogP of 3.45, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine is sourced from PubChem (CID 160984221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).