5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine

C18H19N3OS — CID 102583255

IUPAC5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine
SMILESCOc1c(C)cnc(-c2sc(Nc3ccccc3)nc2C)c1C
InChIInChI=1S/C18H19N3OS/c1-11-10-19-15(12(2)16(11)22-4)17-13(3)20-18(23-17)21-14-8-6-5-7-9-14/h5-10H,1-4H3,(H,20,21)
InChIKeyWFZMKRGQQCHBJL-UHFFFAOYSA-N
MW325.44 g/mol
LogP4.88
Rot. Bonds4

About 5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine

5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine (PubChem CID 102583255) has the molecular formula C18H19N3OS and a molecular weight of 325.44 g/mol. Its IUPAC name is 5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine
PubChem CID102583255
Molecular FormulaC18H19N3OS
Molecular Weight325.44 g/mol
Exact Mass325.12
IUPAC Name5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine
SMILESCOc1c(C)cnc(-c2sc(Nc3ccccc3)nc2C)c1C
InChIInChI=1S/C18H19N3OS/c1-11-10-19-15(12(2)16(11)22-4)17-13(3)20-18(23-17)21-14-8-6-5-7-9-14/h5-10H,1-4H3,(H,20,21)
InChIKeyWFZMKRGQQCHBJL-UHFFFAOYSA-N
XLogP4.88
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.44
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-N-phenyl-5-pyrimidin-4-yl-1,3-thiazol-2-amine
CID 141131243
bis(2-anilino-4-methyl-1,3-thiazol-5-yl)methanone
CID 87664196
4-[(4-methyl-5-phenyl-1,3-thiazol-2-yl)amino]benzoic acid
CID 2384167
3-(4-methoxy-3,5-dimethyl-2-pyridinyl)-6-pyrimidin-2-yl-1,2,4,5-tetrazine
CID 176851091
7-methyl-N-phenyl-[1,3]thiazolo[4,5-b]pyridin-2-amine
CID 13481974
CID 90008084
CID 90008084
2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-1-phenylguanidine;hydroiodide
CID 110917067
2-anilino-6,7-dimethoxy-3,1-benzothiazin-4-one
CID 110193650
ethyl 2-anilino-4-methyl-1,3-thiazole-5-carboxylate
CID 807772
7-N-methyl-2-N,7-N-diphenyl-[1,3]thiazolo[5,4-d]pyrimidine-2,7-diamine
CID 11652884
1-(2-anilino-4-methyl-1,3-thiazol-5-yl)propan-1-one;ethane
CID 144672585
5-quinoxalin-2-yl-2-N-(3,4,5-trimethoxyphenyl)-1,3-thiazole-2,4-diamine
CID 24986814

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine (CID 102583255) is 5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine is COc1c(C)cnc(-c2sc(Nc3ccccc3)nc2C)c1C.
What is the InChIKey of 5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine?
The InChIKey is WFZMKRGQQCHBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3OS/c1-11-10-19-15(12(2)16(11)22-4)17-13(3)20-18(23-17)21-14-8-6-5-7-9-14/h5-10H,1-4H3,(H,20,21).
What are the key properties of 5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine?
5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine has a molecular weight of 325.44 g/mol, XLogP of 4.88, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methyl-N-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 102583255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).