2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine

C12H10F2N2S — CID 62077011

IUPAC2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine
SMILESNc1sc(C2CC2)nc1-c1c(F)cccc1F
InChIInChI=1S/C12H10F2N2S/c13-7-2-1-3-8(14)9(7)10-11(15)17-12(16-10)6-4-5-6/h1-3,6H,4-5,15H2
InChIKeyGUMBBSVZQLMMBN-UHFFFAOYSA-N
MW252.29 g/mol
LogP3.55
Rot. Bonds2

About 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine

2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine (PubChem CID 62077011) has the molecular formula C12H10F2N2S and a molecular weight of 252.29 g/mol. Its IUPAC name is 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine
PubChem CID62077011
Molecular FormulaC12H10F2N2S
Molecular Weight252.29 g/mol
Exact Mass252.05
IUPAC Name2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine
SMILESNc1sc(C2CC2)nc1-c1c(F)cccc1F
InChIInChI=1S/C12H10F2N2S/c13-7-2-1-3-8(14)9(7)10-11(15)17-12(16-10)6-4-5-6/h1-3,6H,4-5,15H2
InChIKeyGUMBBSVZQLMMBN-UHFFFAOYSA-N
XLogP3.55
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-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 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine?
The IUPAC name of 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine (CID 62077011) is 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine.
What is the SMILES notation for 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine?
The canonical SMILES for 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine is Nc1sc(C2CC2)nc1-c1c(F)cccc1F.
What is the InChIKey of 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine?
The InChIKey is GUMBBSVZQLMMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2N2S/c13-7-2-1-3-8(14)9(7)10-11(15)17-12(16-10)6-4-5-6/h1-3,6H,4-5,15H2.
What are the key properties of 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine?
2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine has a molecular weight of 252.29 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine is sourced from PubChem (CID 62077011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).