4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine

C16H15N3O2S — CID 124927933

IUPAC4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine
SMILESCOc1ccc(-c2csc(Nc3ccc(OC)nc3)n2)cc1
InChIInChI=1S/C16H15N3O2S/c1-20-13-6-3-11(4-7-13)14-10-22-16(19-14)18-12-5-8-15(21-2)17-9-12/h3-10H,1-2H3,(H,18,19)
InChIKeyUYKGQCQVAAUDGD-UHFFFAOYSA-N
MW313.38 g/mol
LogP3.97
Rot. Bonds5

About 4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine

4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine (PubChem CID 124927933) has the molecular formula C16H15N3O2S and a molecular weight of 313.38 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine
PubChem CID124927933
Molecular FormulaC16H15N3O2S
Molecular Weight313.38 g/mol
Exact Mass313.09
IUPAC Name4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine
SMILESCOc1ccc(-c2csc(Nc3ccc(OC)nc3)n2)cc1
InChIInChI=1S/C16H15N3O2S/c1-20-13-6-3-11(4-7-13)14-10-22-16(19-14)18-12-5-8-15(21-2)17-9-12/h3-10H,1-2H3,(H,18,19)
InChIKeyUYKGQCQVAAUDGD-UHFFFAOYSA-N
XLogP3.97
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 4093037
N-(6-methoxy-3-pyridinyl)-4-quinazolin-2-yl-1,3-thiazol-2-amine
CID 145386186
N-(4-methoxyphenyl)-4-(4-methylsulfonylphenyl)-1,3-thiazol-2-amine
CID 17398323
4-(3,4-dimethoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine;hydrobromide
CID 2877323
3-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]amino]phenol
CID 768029
[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]hydrazine
CID 5211248
4-(4-chlorophenyl)-N-(6-chloro-3-pyridinyl)-1,3-thiazol-2-amine
CID 166340316
N-[[4-[2-(4-methoxyanilino)-1,3-thiazol-4-yl]phenyl]methyl]acetamide
CID 9343440
4-(4-methoxyphenyl)-N-(2-methylphenyl)-1,3-thiazol-2-amine
CID 853927
4-(2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 8962541
4-methoxy-N-[4-[2-(3-methoxyanilino)-1,3-thiazol-4-yl]phenyl]benzamide
CID 5178891
4-(4-aminophenyl)-N-(4-ethoxyphenyl)-1,3-thiazol-2-amine
CID 13155729

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine (CID 124927933) is 4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine is COc1ccc(-c2csc(Nc3ccc(OC)nc3)n2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine?
The InChIKey is UYKGQCQVAAUDGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2S/c1-20-13-6-3-11(4-7-13)14-10-22-16(19-14)18-12-5-8-15(21-2)17-9-12/h3-10H,1-2H3,(H,18,19).
What are the key properties of 4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine?
4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine has a molecular weight of 313.38 g/mol, XLogP of 3.97, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 124927933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).