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

C12H11ClN2S — CID 62077356

IUPAC4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine
SMILESNc1sc(C2CC2)nc1-c1ccccc1Cl
InChIInChI=1S/C12H11ClN2S/c13-9-4-2-1-3-8(9)10-11(14)16-12(15-10)7-5-6-7/h1-4,7H,5-6,14H2
InChIKeyFWIISAQPTBMKBF-UHFFFAOYSA-N
MW250.75 g/mol
LogP3.92
Rot. Bonds2

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

4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine (PubChem CID 62077356) has the molecular formula C12H11ClN2S and a molecular weight of 250.75 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine.

Molecular Properties

Compound Name4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine
PubChem CID62077356
Molecular FormulaC12H11ClN2S
Molecular Weight250.75 g/mol
Exact Mass250.03
IUPAC Name4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine
SMILESNc1sc(C2CC2)nc1-c1ccccc1Cl
InChIInChI=1S/C12H11ClN2S/c13-9-4-2-1-3-8(9)10-11(14)16-12(15-10)7-5-6-7/h1-4,7H,5-6,14H2
InChIKeyFWIISAQPTBMKBF-UHFFFAOYSA-N
XLogP3.92
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.75
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(2-chlorophenyl)-2-cyclopropyl-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 4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine?
The IUPAC name of 4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine (CID 62077356) is 4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine.
What is the SMILES notation for 4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine?
The canonical SMILES for 4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine is Nc1sc(C2CC2)nc1-c1ccccc1Cl.
What is the InChIKey of 4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine?
The InChIKey is FWIISAQPTBMKBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2S/c13-9-4-2-1-3-8(9)10-11(14)16-12(15-10)7-5-6-7/h1-4,7H,5-6,14H2.
What are the key properties of 4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine?
4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine has a molecular weight of 250.75 g/mol, XLogP of 3.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-2-cyclopropyl-1,3-thiazol-5-amine is sourced from PubChem (CID 62077356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).