N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide

C10H11N5OS — CID 21008228

IUPACN-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide
SMILESCc1cc(C)nc(NC(=O)c2snnc2C)n1
InChIInChI=1S/C10H11N5OS/c1-5-4-6(2)12-10(11-5)13-9(16)8-7(3)14-15-17-8/h4H,1-3H3,(H,11,12,13,16)
InChIKeyPIMFWQQHUYZQAK-UHFFFAOYSA-N
MW249.30 g/mol
LogP1.51
Rot. Bonds2

About N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide

N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide (PubChem CID 21008228) has the molecular formula C10H11N5OS and a molecular weight of 249.30 g/mol. Its IUPAC name is N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide
PubChem CID21008228
Molecular FormulaC10H11N5OS
Molecular Weight249.30 g/mol
Exact Mass249.07
IUPAC NameN-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide
SMILESCc1cc(C)nc(NC(=O)c2snnc2C)n1
InChIInChI=1S/C10H11N5OS/c1-5-4-6(2)12-10(11-5)13-9(16)8-7(3)14-15-17-8/h4H,1-3H3,(H,11,12,13,16)
InChIKeyPIMFWQQHUYZQAK-UHFFFAOYSA-N
XLogP1.51
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.30
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide?
The IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide (CID 21008228) is N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide.
What is the SMILES notation for N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide?
The canonical SMILES for N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide is Cc1cc(C)nc(NC(=O)c2snnc2C)n1.
What is the InChIKey of N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide?
The InChIKey is PIMFWQQHUYZQAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5OS/c1-5-4-6(2)12-10(11-5)13-9(16)8-7(3)14-15-17-8/h4H,1-3H3,(H,11,12,13,16).
What are the key properties of N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide?
N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide has a molecular weight of 249.30 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethylpyrimidin-2-yl)-4-methylthiadiazole-5-carboxamide is sourced from PubChem (CID 21008228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).