N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine

C15H15N5S — CID 52947055

IUPACN-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
SMILESCCCNc1ncc(-c2ccnc(-c3ccccn3)n2)s1
InChIInChI=1S/C15H15N5S/c1-2-7-18-15-19-10-13(21-15)11-6-9-17-14(20-11)12-5-3-4-8-16-12/h3-6,8-10H,2,7H2,1H3,(H,18,19)
InChIKeyHXKNDDUSBPXWJF-UHFFFAOYSA-N
MW297.39 g/mol
LogP3.48
Rot. Bonds5

About N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine

N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine (PubChem CID 52947055) has the molecular formula C15H15N5S and a molecular weight of 297.39 g/mol. Its IUPAC name is N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
PubChem CID52947055
Molecular FormulaC15H15N5S
Molecular Weight297.39 g/mol
Exact Mass297.10
IUPAC NameN-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
SMILESCCCNc1ncc(-c2ccnc(-c3ccccn3)n2)s1
InChIInChI=1S/C15H15N5S/c1-2-7-18-15-19-10-13(21-15)11-6-9-17-14(20-11)12-5-3-4-8-16-12/h3-6,8-10H,2,7H2,1H3,(H,18,19)
InChIKeyHXKNDDUSBPXWJF-UHFFFAOYSA-N
XLogP3.48
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.39
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-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 N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine (CID 52947055) is N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine is CCCNc1ncc(-c2ccnc(-c3ccccn3)n2)s1.
What is the InChIKey of N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine?
The InChIKey is HXKNDDUSBPXWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5S/c1-2-7-18-15-19-10-13(21-15)11-6-9-17-14(20-11)12-5-3-4-8-16-12/h3-6,8-10H,2,7H2,1H3,(H,18,19).
What are the key properties of N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine?
N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine has a molecular weight of 297.39 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-5-(2-pyridin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 52947055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).