4-methyl-2-(1,3-thiazol-2-yloxy)aniline

C10H10N2OS — CID 43364080

IUPAC4-methyl-2-(1,3-thiazol-2-yloxy)aniline
SMILESCc1ccc(N)c(Oc2nccs2)c1
InChIInChI=1S/C10H10N2OS/c1-7-2-3-8(11)9(6-7)13-10-12-4-5-14-10/h2-6H,11H2,1H3
InChIKeyHTJSGRKPLTZLJD-UHFFFAOYSA-N
MW206.27 g/mol
LogP2.83
Rot. Bonds2

About 4-methyl-2-(1,3-thiazol-2-yloxy)aniline

4-methyl-2-(1,3-thiazol-2-yloxy)aniline (PubChem CID 43364080) has the molecular formula C10H10N2OS and a molecular weight of 206.27 g/mol. Its IUPAC name is 4-methyl-2-(1,3-thiazol-2-yloxy)aniline.

Molecular Properties

Compound Name4-methyl-2-(1,3-thiazol-2-yloxy)aniline
PubChem CID43364080
Molecular FormulaC10H10N2OS
Molecular Weight206.27 g/mol
Exact Mass206.05
IUPAC Name4-methyl-2-(1,3-thiazol-2-yloxy)aniline
SMILESCc1ccc(N)c(Oc2nccs2)c1
InChIInChI=1S/C10H10N2OS/c1-7-2-3-8(11)9(6-7)13-10-12-4-5-14-10/h2-6H,11H2,1H3
InChIKeyHTJSGRKPLTZLJD-UHFFFAOYSA-N
XLogP2.83
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-(1,3-thiazol-2-yloxy)benzene-1,2-diamine
CID 21482771
2,5-difluoro-4-(1,3-thiazol-2-yloxy)aniline
CID 63599546
5-bromo-4-fluoro-2-(1,3-thiazol-2-yloxy)aniline
CID 103483890
2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole
CID 155798528
2-(2-chlorophenoxy)-1,3-thiazole
CID 117189206
4-methyl-2-(3-methylphenoxy)aniline
CID 26189584
2-(4-ethoxyphenoxy)-4-methylaniline
CID 26189599
2-(5-iodopyrimidin-4-yl)oxy-4-methylaniline
CID 66340607
2-(fluoromethoxy)-4-methylaniline
CID 123529275
2-(2-ethoxyphenoxy)-4-methylaniline
CID 26189556
2-(3,4-dimethoxyphenoxy)-1,3-thiazole
CID 141204086
2-(4-fluorophenoxy)-4-methylaniline
CID 26189590

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(1,3-thiazol-2-yloxy)aniline?
The IUPAC name of 4-methyl-2-(1,3-thiazol-2-yloxy)aniline (CID 43364080) is 4-methyl-2-(1,3-thiazol-2-yloxy)aniline.
What is the SMILES notation for 4-methyl-2-(1,3-thiazol-2-yloxy)aniline?
The canonical SMILES for 4-methyl-2-(1,3-thiazol-2-yloxy)aniline is Cc1ccc(N)c(Oc2nccs2)c1.
What is the InChIKey of 4-methyl-2-(1,3-thiazol-2-yloxy)aniline?
The InChIKey is HTJSGRKPLTZLJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2OS/c1-7-2-3-8(11)9(6-7)13-10-12-4-5-14-10/h2-6H,11H2,1H3.
What are the key properties of 4-methyl-2-(1,3-thiazol-2-yloxy)aniline?
4-methyl-2-(1,3-thiazol-2-yloxy)aniline has a molecular weight of 206.27 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(1,3-thiazol-2-yloxy)aniline is sourced from PubChem (CID 43364080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).