2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine

C15H16N2S — CID 79976761

IUPAC2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
SMILESc1ccc(C2CC2)c(-c2nc3c(s2)CNCC3)c1
InChIInChI=1S/C15H16N2S/c1-2-4-12(11(3-1)10-5-6-10)15-17-13-7-8-16-9-14(13)18-15/h1-4,10,16H,5-9H2
InChIKeyPSSRQRZIWBJXBD-UHFFFAOYSA-N
MW256.37 g/mol
LogP3.33
Rot. Bonds2

About 2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine

2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine (PubChem CID 79976761) has the molecular formula C15H16N2S and a molecular weight of 256.37 g/mol. Its IUPAC name is 2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine.

Molecular Properties

Compound Name2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
PubChem CID79976761
Molecular FormulaC15H16N2S
Molecular Weight256.37 g/mol
Exact Mass256.10
IUPAC Name2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
SMILESc1ccc(C2CC2)c(-c2nc3c(s2)CNCC3)c1
InChIInChI=1S/C15H16N2S/c1-2-4-12(11(3-1)10-5-6-10)15-17-13-7-8-16-9-14(13)18-15/h1-4,10,16H,5-9H2
InChIKeyPSSRQRZIWBJXBD-UHFFFAOYSA-N
XLogP3.33
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine 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-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
The IUPAC name of 2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine (CID 79976761) is 2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine.
What is the SMILES notation for 2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
The canonical SMILES for 2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine is c1ccc(C2CC2)c(-c2nc3c(s2)CNCC3)c1.
What is the InChIKey of 2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
The InChIKey is PSSRQRZIWBJXBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2S/c1-2-4-12(11(3-1)10-5-6-10)15-17-13-7-8-16-9-14(13)18-15/h1-4,10,16H,5-9H2.
What are the key properties of 2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine has a molecular weight of 256.37 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine is sourced from PubChem (CID 79976761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).