5-benzyl-1,3-thiazol-2-amine

C10H10N2S — CID 691952

IUPAC5-benzyl-1,3-thiazol-2-amine
SMILESNc1ncc(Cc2ccccc2)s1
InChIInChI=1S/C10H10N2S/c11-10-12-7-9(13-10)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,11,12)
InChIKeyFJIMLXBJUVLMMN-UHFFFAOYSA-N
MW190.27 g/mol
LogP2.32
Rot. Bonds2

About 5-benzyl-1,3-thiazol-2-amine

5-benzyl-1,3-thiazol-2-amine (PubChem CID 691952) has the molecular formula C10H10N2S and a molecular weight of 190.27 g/mol. Its IUPAC name is 5-benzyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-benzyl-1,3-thiazol-2-amine
PubChem CID691952
Molecular FormulaC10H10N2S
Molecular Weight190.27 g/mol
Exact Mass190.06
IUPAC Name5-benzyl-1,3-thiazol-2-amine
SMILESNc1ncc(Cc2ccccc2)s1
InChIInChI=1S/C10H10N2S/c11-10-12-7-9(13-10)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,11,12)
InChIKeyFJIMLXBJUVLMMN-UHFFFAOYSA-N
XLogP2.32
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-benzyl-1,3-thiazol-2-amine?
The IUPAC name of 5-benzyl-1,3-thiazol-2-amine (CID 691952) is 5-benzyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-benzyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-benzyl-1,3-thiazol-2-amine is Nc1ncc(Cc2ccccc2)s1.
What is the InChIKey of 5-benzyl-1,3-thiazol-2-amine?
The InChIKey is FJIMLXBJUVLMMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2S/c11-10-12-7-9(13-10)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,11,12).
What are the key properties of 5-benzyl-1,3-thiazol-2-amine?
5-benzyl-1,3-thiazol-2-amine has a molecular weight of 190.27 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-1,3-thiazol-2-amine is sourced from PubChem (CID 691952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).