2-propan-2-ylsulfanyl-1,3-thiazol-4-amine

C6H10N2S2 — CID 117189260

IUPAC2-propan-2-ylsulfanyl-1,3-thiazol-4-amine
SMILESCC(C)Sc1nc(N)cs1
InChIInChI=1S/C6H10N2S2/c1-4(2)10-6-8-5(7)3-9-6/h3-4H,7H2,1-2H3
InChIKeyUJFYYHSLNFBVGT-UHFFFAOYSA-N
MW174.29 g/mol
LogP2.23
Rot. Bonds2

About 2-propan-2-ylsulfanyl-1,3-thiazol-4-amine

2-propan-2-ylsulfanyl-1,3-thiazol-4-amine (PubChem CID 117189260) has the molecular formula C6H10N2S2 and a molecular weight of 174.29 g/mol. Its IUPAC name is 2-propan-2-ylsulfanyl-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-propan-2-ylsulfanyl-1,3-thiazol-4-amine
PubChem CID117189260
Molecular FormulaC6H10N2S2
Molecular Weight174.29 g/mol
Exact Mass174.03
IUPAC Name2-propan-2-ylsulfanyl-1,3-thiazol-4-amine
SMILESCC(C)Sc1nc(N)cs1
InChIInChI=1S/C6H10N2S2/c1-4(2)10-6-8-5(7)3-9-6/h3-4H,7H2,1-2H3
InChIKeyUJFYYHSLNFBVGT-UHFFFAOYSA-N
XLogP2.23
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.29
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-ylsulfanyl-1,3-thiazol-4-amine?
The IUPAC name of 2-propan-2-ylsulfanyl-1,3-thiazol-4-amine (CID 117189260) is 2-propan-2-ylsulfanyl-1,3-thiazol-4-amine.
What is the SMILES notation for 2-propan-2-ylsulfanyl-1,3-thiazol-4-amine?
The canonical SMILES for 2-propan-2-ylsulfanyl-1,3-thiazol-4-amine is CC(C)Sc1nc(N)cs1.
What is the InChIKey of 2-propan-2-ylsulfanyl-1,3-thiazol-4-amine?
The InChIKey is UJFYYHSLNFBVGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2S2/c1-4(2)10-6-8-5(7)3-9-6/h3-4H,7H2,1-2H3.
What are the key properties of 2-propan-2-ylsulfanyl-1,3-thiazol-4-amine?
2-propan-2-ylsulfanyl-1,3-thiazol-4-amine has a molecular weight of 174.29 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-ylsulfanyl-1,3-thiazol-4-amine is sourced from PubChem (CID 117189260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).