2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine

C13H10N4S — CID 95857470

IUPAC2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine
SMILESCc1ncc(-c2cnccn2)c(-c2cccs2)n1
InChIInChI=1S/C13H10N4S/c1-9-16-7-10(11-8-14-4-5-15-11)13(17-9)12-3-2-6-18-12/h2-8H,1H3
InChIKeyOYJMPYYCEAYJMX-UHFFFAOYSA-N
MW254.32 g/mol
LogP2.97
Rot. Bonds2

About 2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine

2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine (PubChem CID 95857470) has the molecular formula C13H10N4S and a molecular weight of 254.32 g/mol. Its IUPAC name is 2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine.

Molecular Properties

Compound Name2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine
PubChem CID95857470
Molecular FormulaC13H10N4S
Molecular Weight254.32 g/mol
Exact Mass254.06
IUPAC Name2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine
SMILESCc1ncc(-c2cnccn2)c(-c2cccs2)n1
InChIInChI=1S/C13H10N4S/c1-9-16-7-10(11-8-14-4-5-15-11)13(17-9)12-3-2-6-18-12/h2-8H,1H3
InChIKeyOYJMPYYCEAYJMX-UHFFFAOYSA-N
XLogP2.97
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.32
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclohexyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidin-2-amine
CID 95800139
N-[(3-methoxyphenyl)methyl]-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidin-2-amine
CID 95800143
ethane;propane;2-thiophen-2-ylpyrazine
CID 142831454
1-(5-pyrazin-2-yl-4-thiophen-2-ylpyrimidin-2-yl)piperidin-3-ol
CID 110220030
N-[(2S)-4-(furan-2-yl)butan-2-yl]-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidin-2-amine
CID 95800147
4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole
CID 73439763
(8aR)-2-(5-pyrazin-2-yl-4-thiophen-2-ylpyrimidin-2-yl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 95800124
N-propan-2-yl-2-[4-(5-pyrazin-2-yl-4-thiophen-2-ylpyrimidin-2-yl)piperazin-1-yl]acetamide
CID 95801226
2-methyl-5-thiophen-2-ylpyrimidine
CID 54054310
N,N-dimethyl-4-(5-methylthiophen-2-yl)-5-pyrazin-2-ylpyrimidin-2-amine
CID 95857472
2-methyl-7-thiophen-2-ylpyrido[2,3-d]pyrimidine
CID 23353104
3-methyl-6-thiophen-2-yl-1,2,4-triazine
CID 135139824

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine?
The IUPAC name of 2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine (CID 95857470) is 2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine.
What is the SMILES notation for 2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine?
The canonical SMILES for 2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine is Cc1ncc(-c2cnccn2)c(-c2cccs2)n1.
What is the InChIKey of 2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine?
The InChIKey is OYJMPYYCEAYJMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4S/c1-9-16-7-10(11-8-14-4-5-15-11)13(17-9)12-3-2-6-18-12/h2-8H,1H3.
What are the key properties of 2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine?
2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine has a molecular weight of 254.32 g/mol, XLogP of 2.97, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidine is sourced from PubChem (CID 95857470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).