2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide

C19H20N6OS — CID 57428353

IUPAC2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide
SMILESO=C(CN1CCCCC1)Nc1cc(-c2nccs2)nc(-c2ccccn2)n1
InChIInChI=1S/C19H20N6OS/c26-17(13-25-9-4-1-5-10-25)23-16-12-15(19-21-8-11-27-19)22-18(24-16)14-6-2-3-7-20-14/h2-3,6-8,11-12H,1,4-5,9-10,13H2,(H,22,23,24,26)
InChIKeyIXUSZODKMMBSQD-UHFFFAOYSA-N
MW380.48 g/mol
LogP3.09
Rot. Bonds5

About 2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide

2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide (PubChem CID 57428353) has the molecular formula C19H20N6OS and a molecular weight of 380.48 g/mol. Its IUPAC name is 2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide.

Molecular Properties

Compound Name2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide
PubChem CID57428353
Molecular FormulaC19H20N6OS
Molecular Weight380.48 g/mol
Exact Mass380.14
IUPAC Name2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide
SMILESO=C(CN1CCCCC1)Nc1cc(-c2nccs2)nc(-c2ccccn2)n1
InChIInChI=1S/C19H20N6OS/c26-17(13-25-9-4-1-5-10-25)23-16-12-15(19-21-8-11-27-19)22-18(24-16)14-6-2-3-7-20-14/h2-3,6-8,11-12H,1,4-5,9-10,13H2,(H,22,23,24,26)
InChIKeyIXUSZODKMMBSQD-UHFFFAOYSA-N
XLogP3.09
TPSA83.90 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.48
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide 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-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide?
The IUPAC name of 2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide (CID 57428353) is 2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide.
What is the SMILES notation for 2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide?
The canonical SMILES for 2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide is O=C(CN1CCCCC1)Nc1cc(-c2nccs2)nc(-c2ccccn2)n1.
What is the InChIKey of 2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide?
The InChIKey is IXUSZODKMMBSQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6OS/c26-17(13-25-9-4-1-5-10-25)23-16-12-15(19-21-8-11-27-19)22-18(24-16)14-6-2-3-7-20-14/h2-3,6-8,11-12H,1,4-5,9-10,13H2,(H,22,23,24,26).
What are the key properties of 2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide?
2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide has a molecular weight of 380.48 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-1-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide is sourced from PubChem (CID 57428353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).