2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol

C10H10N2OS — CID 11635017

IUPAC2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol
SMILESCc1ccc(O)c(-c2csc(N)n2)c1
InChIInChI=1S/C10H10N2OS/c1-6-2-3-9(13)7(4-6)8-5-14-10(11)12-8/h2-5,13H,1H3,(H2,11,12)
InChIKeyJMLQQWPWAGJCEQ-UHFFFAOYSA-N
MW206.27 g/mol
LogP2.41
Rot. Bonds1

About 2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol

2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol (PubChem CID 11635017) has the molecular formula C10H10N2OS and a molecular weight of 206.27 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol
PubChem CID11635017
Molecular FormulaC10H10N2OS
Molecular Weight206.27 g/mol
Exact Mass206.05
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol
SMILESCc1ccc(O)c(-c2csc(N)n2)c1
InChIInChI=1S/C10H10N2OS/c1-6-2-3-9(13)7(4-6)8-5-14-10(11)12-8/h2-5,13H,1H3,(H2,11,12)
InChIKeyJMLQQWPWAGJCEQ-UHFFFAOYSA-N
XLogP2.41
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol (CID 11635017) is 2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol is Cc1ccc(O)c(-c2csc(N)n2)c1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol?
The InChIKey is JMLQQWPWAGJCEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2OS/c1-6-2-3-9(13)7(4-6)8-5-14-10(11)12-8/h2-5,13H,1H3,(H2,11,12).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol?
2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol has a molecular weight of 206.27 g/mol, XLogP of 2.41, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-4-methylphenol is sourced from PubChem (CID 11635017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).