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

C19H14N6OS — CID 69282501

IUPAC2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide
SMILESO=C(Cc1cccnc1)Nc1cc(-c2nccs2)nc(-c2ccccn2)n1
InChIInChI=1S/C19H14N6OS/c26-17(10-13-4-3-6-20-12-13)24-16-11-15(19-22-8-9-27-19)23-18(25-16)14-5-1-2-7-21-14/h1-9,11-12H,10H2,(H,23,24,25,26)
InChIKeyLXHSGMFUDIGMMQ-UHFFFAOYSA-N
MW374.43 g/mol
LogP3.24
Rot. Bonds5

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

2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide (PubChem CID 69282501) has the molecular formula C19H14N6OS and a molecular weight of 374.43 g/mol. Its IUPAC name is 2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide.

Molecular Properties

Compound Name2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide
PubChem CID69282501
Molecular FormulaC19H14N6OS
Molecular Weight374.43 g/mol
Exact Mass374.09
IUPAC Name2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide
SMILESO=C(Cc1cccnc1)Nc1cc(-c2nccs2)nc(-c2ccccn2)n1
InChIInChI=1S/C19H14N6OS/c26-17(10-13-4-3-6-20-12-13)24-16-11-15(19-22-8-9-27-19)23-18(25-16)14-5-1-2-7-21-14/h1-9,11-12H,10H2,(H,23,24,25,26)
InChIKeyLXHSGMFUDIGMMQ-UHFFFAOYSA-N
XLogP3.24
TPSA93.55 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.43
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide?
The IUPAC name of 2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide (CID 69282501) is 2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide.
What is the SMILES notation for 2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide?
The canonical SMILES for 2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide is O=C(Cc1cccnc1)Nc1cc(-c2nccs2)nc(-c2ccccn2)n1.
What is the InChIKey of 2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide?
The InChIKey is LXHSGMFUDIGMMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N6OS/c26-17(10-13-4-3-6-20-12-13)24-16-11-15(19-22-8-9-27-19)23-18(25-16)14-5-1-2-7-21-14/h1-9,11-12H,10H2,(H,23,24,25,26).
What are the key properties of 2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide?
2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide has a molecular weight of 374.43 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-yl-N-[2-pyridin-2-yl-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide is sourced from PubChem (CID 69282501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).