5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine

C20H22N2O3S — CID 53387890

IUPAC5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
SMILESCCc1ccc(-c2sc(N)nc2-c2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C20H22N2O3S/c1-5-12-6-8-13(9-7-12)19-17(22-20(21)26-19)14-10-15(23-2)18(25-4)16(11-14)24-3/h6-11H,5H2,1-4H3,(H2,21,22)
InChIKeyJNRATHZLJKXNCF-UHFFFAOYSA-N
MW370.47 g/mol
LogP4.65
Rot. Bonds6

About 5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine

5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine (PubChem CID 53387890) has the molecular formula C20H22N2O3S and a molecular weight of 370.47 g/mol. Its IUPAC name is 5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
PubChem CID53387890
Molecular FormulaC20H22N2O3S
Molecular Weight370.47 g/mol
Exact Mass370.14
IUPAC Name5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
SMILESCCc1ccc(-c2sc(N)nc2-c2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C20H22N2O3S/c1-5-12-6-8-13(9-7-12)19-17(22-20(21)26-19)14-10-15(23-2)18(25-4)16(11-14)24-3/h6-11H,5H2,1-4H3,(H2,21,22)
InChIKeyJNRATHZLJKXNCF-UHFFFAOYSA-N
XLogP4.65
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.47
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(3,4-Dimethoxyphenyl)-1,3-thiazol-2-amine
CID 332397
4-(4-Methoxyphenyl)-5-methyl-1,3-thiazol-2-amine
CID 613228
5-Ethyl-4-(4-methoxy-phenyl)-thiazol-2-ylamine
CID 828523
6-(3,4-dimethoxyphenyl)-8H-indeno(1,2-d)(1,3)thiazol-2-amine hydroiodide
CID 49797019
5-(4-Ethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
CID 53380487
5-(1-Benzothiophen-2-yl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
CID 53387733
5-(4-Methylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
CID 53387889
5-[4-(Trifluoromethyl)phenyl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
CID 53387891
5-(4-Methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
CID 53387892
5-(3-Chloro-4-ethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
CID 53388045
5-(4-ethoxyphenyl)-N-methyl-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine
CID 71461486
5-Methyl-4-(4-phenoxy-phenyl)-thiazol-2-ylamine
CID 828522

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine (CID 53387890) is 5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine is CCc1ccc(-c2sc(N)nc2-c2cc(OC)c(OC)c(OC)c2)cc1.
What is the InChIKey of 5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is JNRATHZLJKXNCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3S/c1-5-12-6-8-13(9-7-12)19-17(22-20(21)26-19)14-10-15(23-2)18(25-4)16(11-14)24-3/h6-11H,5H2,1-4H3,(H2,21,22).
What are the key properties of 5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine?
5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 370.47 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 53387890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).