methane;2-methylpropane;1,3-thiazole

C8H17NS — CID 158903774

IUPACmethane;2-methylpropane;1,3-thiazole
SMILESC.CC(C)C.c1cscn1
InChIInChI=1S/C4H10.C3H3NS.CH4/c1-4(2)3;1-2-5-3-4-1;/h4H,1-3H3;1-3H;1H4
InChIKeyJFTVXGIVHTUPMO-UHFFFAOYSA-N
MW159.30 g/mol
LogP3.44
Rot. Bonds

About methane;2-methylpropane;1,3-thiazole

methane;2-methylpropane;1,3-thiazole (PubChem CID 158903774) has the molecular formula C8H17NS and a molecular weight of 159.30 g/mol. Its IUPAC name is methane;2-methylpropane;1,3-thiazole.

Molecular Properties

Compound Namemethane;2-methylpropane;1,3-thiazole
PubChem CID158903774
Molecular FormulaC8H17NS
Molecular Weight159.30 g/mol
Exact Mass159.11
IUPAC Namemethane;2-methylpropane;1,3-thiazole
SMILESC.CC(C)C.c1cscn1
InChIInChI=1S/C4H10.C3H3NS.CH4/c1-4(2)3;1-2-5-3-4-1;/h4H,1-3H3;1-3H;1H4
InChIKeyJFTVXGIVHTUPMO-UHFFFAOYSA-N
XLogP3.44
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.30
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of methane;2-methylpropane;1,3-thiazole?
The IUPAC name of methane;2-methylpropane;1,3-thiazole (CID 158903774) is methane;2-methylpropane;1,3-thiazole.
What is the SMILES notation for methane;2-methylpropane;1,3-thiazole?
The canonical SMILES for methane;2-methylpropane;1,3-thiazole is C.CC(C)C.c1cscn1.
What is the InChIKey of methane;2-methylpropane;1,3-thiazole?
The InChIKey is JFTVXGIVHTUPMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10.C3H3NS.CH4/c1-4(2)3;1-2-5-3-4-1;/h4H,1-3H3;1-3H;1H4.
What are the key properties of methane;2-methylpropane;1,3-thiazole?
methane;2-methylpropane;1,3-thiazole has a molecular weight of 159.30 g/mol, XLogP of 3.44, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-methylpropane;1,3-thiazole is sourced from PubChem (CID 158903774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).