4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine

C15H15N3OS — CID 72720166

IUPAC4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine
SMILESCc1cc(-c2csc(Nc3cnccc3C)n2)c(C)o1
InChIInChI=1S/C15H15N3OS/c1-9-4-5-16-7-13(9)17-15-18-14(8-20-15)12-6-10(2)19-11(12)3/h4-8H,1-3H3,(H,17,18)
InChIKeyGHJHGFAZHFLQRY-UHFFFAOYSA-N
MW285.37 g/mol
LogP4.47
Rot. Bonds3

About 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine

4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine (PubChem CID 72720166) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine
PubChem CID72720166
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC Name4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine
SMILESCc1cc(-c2csc(Nc3cnccc3C)n2)c(C)o1
InChIInChI=1S/C15H15N3OS/c1-9-4-5-16-7-13(9)17-15-18-14(8-20-15)12-6-10(2)19-11(12)3/h4-8H,1-3H3,(H,17,18)
InChIKeyGHJHGFAZHFLQRY-UHFFFAOYSA-N
XLogP4.47
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine (CID 72720166) is 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine is Cc1cc(-c2csc(Nc3cnccc3C)n2)c(C)o1.
What is the InChIKey of 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine?
The InChIKey is GHJHGFAZHFLQRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-9-4-5-16-7-13(9)17-15-18-14(8-20-15)12-6-10(2)19-11(12)3/h4-8H,1-3H3,(H,17,18).
What are the key properties of 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine?
4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine has a molecular weight of 285.37 g/mol, XLogP of 4.47, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylfuran-3-yl)-N-(4-methyl-3-pyridinyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 72720166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).