2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine

C16H14N2S — CID 62082548

IUPAC2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine
SMILESCc1nc(-c2ccc(-c3ccccc3)cc2)c(N)s1
InChIInChI=1S/C16H14N2S/c1-11-18-15(16(17)19-11)14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-10H,17H2,1H3
InChIKeyXMOYBFMRFRPABE-UHFFFAOYSA-N
MW266.37 g/mol
LogP4.37
Rot. Bonds2

About 2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine

2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine (PubChem CID 62082548) has the molecular formula C16H14N2S and a molecular weight of 266.37 g/mol. Its IUPAC name is 2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine
PubChem CID62082548
Molecular FormulaC16H14N2S
Molecular Weight266.37 g/mol
Exact Mass266.09
IUPAC Name2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine
SMILESCc1nc(-c2ccc(-c3ccccc3)cc2)c(N)s1
InChIInChI=1S/C16H14N2S/c1-11-18-15(16(17)19-11)14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-10H,17H2,1H3
InChIKeyXMOYBFMRFRPABE-UHFFFAOYSA-N
XLogP4.37
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine?
The IUPAC name of 2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine (CID 62082548) is 2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine.
What is the SMILES notation for 2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine?
The canonical SMILES for 2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine is Cc1nc(-c2ccc(-c3ccccc3)cc2)c(N)s1.
What is the InChIKey of 2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine?
The InChIKey is XMOYBFMRFRPABE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2S/c1-11-18-15(16(17)19-11)14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-10H,17H2,1H3.
What are the key properties of 2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine?
2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine has a molecular weight of 266.37 g/mol, XLogP of 4.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(4-phenylphenyl)-1,3-thiazol-5-amine is sourced from PubChem (CID 62082548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).