5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine

C15H20N2S — CID 63296192

IUPAC5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCc1cc(C)c(NC2=NCC(C3CC3)S2)c(C)c1
InChIInChI=1S/C15H20N2S/c1-9-6-10(2)14(11(3)7-9)17-15-16-8-13(18-15)12-4-5-12/h6-7,12-13H,4-5,8H2,1-3H3,(H,16,17)
InChIKeyWNFKLGZEUBVABC-UHFFFAOYSA-N
MW260.41 g/mol
LogP3.91
Rot. Bonds2

About 5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine

5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 63296192) has the molecular formula C15H20N2S and a molecular weight of 260.41 g/mol. Its IUPAC name is 5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID63296192
Molecular FormulaC15H20N2S
Molecular Weight260.41 g/mol
Exact Mass260.13
IUPAC Name5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCc1cc(C)c(NC2=NCC(C3CC3)S2)c(C)c1
InChIInChI=1S/C15H20N2S/c1-9-6-10(2)14(11(3)7-9)17-15-16-8-13(18-15)12-4-5-12/h6-7,12-13H,4-5,8H2,1-3H3,(H,16,17)
InChIKeyWNFKLGZEUBVABC-UHFFFAOYSA-N
XLogP3.91
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.41
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine (CID 63296192) is 5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine is Cc1cc(C)c(NC2=NCC(C3CC3)S2)c(C)c1.
What is the InChIKey of 5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is WNFKLGZEUBVABC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2S/c1-9-6-10(2)14(11(3)7-9)17-15-16-8-13(18-15)12-4-5-12/h6-7,12-13H,4-5,8H2,1-3H3,(H,16,17).
What are the key properties of 5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine?
5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 260.41 g/mol, XLogP of 3.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(2,4,6-trimethylphenyl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 63296192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).