4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine

C17H16N2O2S — CID 8962541

IUPAC4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccc(Nc2nc(-c3ccccc3OC)cs2)cc1
InChIInChI=1S/C17H16N2O2S/c1-20-13-9-7-12(8-10-13)18-17-19-15(11-22-17)14-5-3-4-6-16(14)21-2/h3-11H,1-2H3,(H,18,19)
InChIKeyQMISKGIVUQUCAL-UHFFFAOYSA-N
MW312.39 g/mol
LogP4.57
Rot. Bonds5

About 4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine

4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine (PubChem CID 8962541) has the molecular formula C17H16N2O2S and a molecular weight of 312.39 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
PubChem CID8962541
Molecular FormulaC17H16N2O2S
Molecular Weight312.39 g/mol
Exact Mass312.09
IUPAC Name4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccc(Nc2nc(-c3ccccc3OC)cs2)cc1
InChIInChI=1S/C17H16N2O2S/c1-20-13-9-7-12(8-10-13)18-17-19-15(11-22-17)14-5-3-4-6-16(14)21-2/h3-11H,1-2H3,(H,18,19)
InChIKeyQMISKGIVUQUCAL-UHFFFAOYSA-N
XLogP4.57
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-methoxyphenyl)-N-phenyl-1,3-thiazol-2-amine
CID 4806347
4-N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]benzene-1,4-diamine
CID 25101048
4-(5-fluoro-2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 8962514
N-(3,4-dichlorophenyl)-4-(2-methoxyphenyl)-1,3-thiazol-2-amine
CID 5168594
4-(2-methoxyphenyl)-N-[(Z)-(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
CID 8878425
N-(1,3-benzodioxol-5-yl)-4-(2-methoxyphenyl)-1,3-thiazol-2-amine
CID 70696152
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(2-methoxyphenyl)-1,3-thiazol-2-amine
CID 58910459
N-(4-methoxyphenyl)-4-pyridin-2-yl-1,3-thiazol-2-amine;hydrochloride
CID 126477222
4-(3,4-dimethoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine;hydrobromide
CID 2877323
4-(2,4-dimethoxyphenyl)-N-(3,5-dimethylphenyl)-1,3-thiazol-2-amine
CID 7954962
4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 4093037
4-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)-1,3-thiazol-2-amine
CID 101224288

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine (CID 8962541) is 4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine is COc1ccc(Nc2nc(-c3ccccc3OC)cs2)cc1.
What is the InChIKey of 4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is QMISKGIVUQUCAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2S/c1-20-13-9-7-12(8-10-13)18-17-19-15(11-22-17)14-5-3-4-6-16(14)21-2/h3-11H,1-2H3,(H,18,19).
What are the key properties of 4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine?
4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 312.39 g/mol, XLogP of 4.57, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 8962541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).