N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine

C15H16N2S2 — CID 59864028

IUPACN-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESc1ccc(C(Cc2cccs2)NC2=NCCS2)cc1
InChIInChI=1S/C15H16N2S2/c1-2-5-12(6-3-1)14(11-13-7-4-9-18-13)17-15-16-8-10-19-15/h1-7,9,14H,8,10-11H2,(H,16,17)
InChIKeyGBUZIHLYXZYHDA-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.72
Rot. Bonds4

About N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine

N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 59864028) has the molecular formula C15H16N2S2 and a molecular weight of 288.44 g/mol. Its IUPAC name is N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID59864028
Molecular FormulaC15H16N2S2
Molecular Weight288.44 g/mol
Exact Mass288.08
IUPAC NameN-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESc1ccc(C(Cc2cccs2)NC2=NCCS2)cc1
InChIInChI=1S/C15H16N2S2/c1-2-5-12(6-3-1)14(11-13-7-4-9-18-13)17-15-16-8-10-19-15/h1-7,9,14H,8,10-11H2,(H,16,17)
InChIKeyGBUZIHLYXZYHDA-UHFFFAOYSA-N
XLogP3.72
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine (CID 59864028) is N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine is c1ccc(C(Cc2cccs2)NC2=NCCS2)cc1.
What is the InChIKey of N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is GBUZIHLYXZYHDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2S2/c1-2-5-12(6-3-1)14(11-13-7-4-9-18-13)17-15-16-8-10-19-15/h1-7,9,14H,8,10-11H2,(H,16,17).
What are the key properties of N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine?
N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 288.44 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenyl-2-thiophen-2-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 59864028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).