5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine

C13H17N3OS — CID 39363228

IUPAC5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccc(C)cc1-c1nc(N)sc1CCN
InChIInChI=1S/C13H17N3OS/c1-8-3-4-10(17-2)9(7-8)12-11(5-6-14)18-13(15)16-12/h3-4,7H,5-6,14H2,1-2H3,(H2,15,16)
InChIKeyDRIJCTQMAXVGIO-UHFFFAOYSA-N
MW263.37 g/mol
LogP2.21
Rot. Bonds4

About 5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine

5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine (PubChem CID 39363228) has the molecular formula C13H17N3OS and a molecular weight of 263.37 g/mol. Its IUPAC name is 5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine
PubChem CID39363228
Molecular FormulaC13H17N3OS
Molecular Weight263.37 g/mol
Exact Mass263.11
IUPAC Name5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccc(C)cc1-c1nc(N)sc1CCN
InChIInChI=1S/C13H17N3OS/c1-8-3-4-10(17-2)9(7-8)12-11(5-6-14)18-13(15)16-12/h3-4,7H,5-6,14H2,1-2H3,(H2,15,16)
InChIKeyDRIJCTQMAXVGIO-UHFFFAOYSA-N
XLogP2.21
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-5-yl]ethanamine
CID 28709823
5-(2-chloroethyl)-4-(2-methoxy-5-methylphenyl)-2-methyl-1,3-thiazole
CID 28710063
2-[5-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]ethanamine
CID 82296518
2-[2-(2-methoxy-4-methylphenyl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 106793197
2-[4-(4-methoxy-2,5-dimethylphenyl)-2-methyl-1,3-thiazol-5-yl]ethanamine
CID 93189901
2-[4-(2-methoxy-5-methylphenyl)-2-methyl-1,3-thiazol-5-yl]acetic acid
CID 39376254
2-[5-(2-methoxy-5-methylphenyl)-1H-imidazol-2-yl]ethanamine
CID 43650904
4-(5-ethyl-2-methoxyphenyl)-1,3-thiazole-2,5-diamine
CID 82480643
[4-(2,5-dimethoxyphenyl)-2-methyl-1,3-thiazol-5-yl]methanamine
CID 28709843
4-(2-methoxy-5-methylphenyl)-6-methylpyrimidin-5-amine
CID 82391060
[3-(2-methoxy-5-methylphenyl)-5-methyl-1H-pyrazol-4-yl]methanamine
CID 82474858
2-[2-(2,5-dimethoxyphenyl)-4-methylphenyl]ethanamine
CID 137354597

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine (CID 39363228) is 5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine is COc1ccc(C)cc1-c1nc(N)sc1CCN.
What is the InChIKey of 5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine?
The InChIKey is DRIJCTQMAXVGIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3OS/c1-8-3-4-10(17-2)9(7-8)12-11(5-6-14)18-13(15)16-12/h3-4,7H,5-6,14H2,1-2H3,(H2,15,16).
What are the key properties of 5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine?
5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine has a molecular weight of 263.37 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 39363228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).