N-benzyl-N-phenyl-1,3-thiazol-2-amine

C16H14N2S — CID 66835487

IUPACN-benzyl-N-phenyl-1,3-thiazol-2-amine
SMILESc1ccc(CN(c2ccccc2)c2nccs2)cc1
InChIInChI=1S/C16H14N2S/c1-3-7-14(8-4-1)13-18(16-17-11-12-19-16)15-9-5-2-6-10-15/h1-12H,13H2
InChIKeyVJQDGAUHVGYSNY-UHFFFAOYSA-N
MW266.37 g/mol
LogP4.48
Rot. Bonds4

About N-benzyl-N-phenyl-1,3-thiazol-2-amine

N-benzyl-N-phenyl-1,3-thiazol-2-amine (PubChem CID 66835487) has the molecular formula C16H14N2S and a molecular weight of 266.37 g/mol. Its IUPAC name is N-benzyl-N-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-benzyl-N-phenyl-1,3-thiazol-2-amine
PubChem CID66835487
Molecular FormulaC16H14N2S
Molecular Weight266.37 g/mol
Exact Mass266.09
IUPAC NameN-benzyl-N-phenyl-1,3-thiazol-2-amine
SMILESc1ccc(CN(c2ccccc2)c2nccs2)cc1
InChIInChI=1S/C16H14N2S/c1-3-7-14(8-4-1)13-18(16-17-11-12-19-16)15-9-5-2-6-10-15/h1-12H,13H2
InChIKeyVJQDGAUHVGYSNY-UHFFFAOYSA-N
XLogP4.48
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-phenyl-1,3-thiazol-2-amine?
The IUPAC name of N-benzyl-N-phenyl-1,3-thiazol-2-amine (CID 66835487) is N-benzyl-N-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-benzyl-N-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for N-benzyl-N-phenyl-1,3-thiazol-2-amine is c1ccc(CN(c2ccccc2)c2nccs2)cc1.
What is the InChIKey of N-benzyl-N-phenyl-1,3-thiazol-2-amine?
The InChIKey is VJQDGAUHVGYSNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2S/c1-3-7-14(8-4-1)13-18(16-17-11-12-19-16)15-9-5-2-6-10-15/h1-12H,13H2.
What are the key properties of N-benzyl-N-phenyl-1,3-thiazol-2-amine?
N-benzyl-N-phenyl-1,3-thiazol-2-amine has a molecular weight of 266.37 g/mol, XLogP of 4.48, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 66835487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).