4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine

C10H12N4OS2 — CID 87886184

IUPAC4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine
SMILESCc1cc(Nc2nc(C)cs2)nc(S(C)=O)n1
InChIInChI=1S/C10H12N4OS2/c1-6-4-8(14-10(12-6)17(3)15)13-9-11-7(2)5-16-9/h4-5H,1-3H3,(H,11,12,13,14)
InChIKeyVKQPIBDUDQEMKS-UHFFFAOYSA-N
MW268.37 g/mol
LogP2.03
Rot. Bonds3

About 4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine

4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine (PubChem CID 87886184) has the molecular formula C10H12N4OS2 and a molecular weight of 268.37 g/mol. Its IUPAC name is 4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine
PubChem CID87886184
Molecular FormulaC10H12N4OS2
Molecular Weight268.37 g/mol
Exact Mass268.05
IUPAC Name4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine
SMILESCc1cc(Nc2nc(C)cs2)nc(S(C)=O)n1
InChIInChI=1S/C10H12N4OS2/c1-6-4-8(14-10(12-6)17(3)15)13-9-11-7(2)5-16-9/h4-5H,1-3H3,(H,11,12,13,14)
InChIKeyVKQPIBDUDQEMKS-UHFFFAOYSA-N
XLogP2.03
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.37
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-{[(4,6-Dimethylpyrimidin-2-yl)sulfanyl]methyl}-1,3-thiazol-2-amine
CID 683952
2-(4,6-Diamino-pyrimidin-2-ylsulfanyl)-N-(4,5-dimethyl-thiazol-2-yl)-acetamide
CID 3173027
4-N-[3-(2-amino-1,3-thiazol-4-yl)propyl]-6-ethylpyrimidine-2,4-diamine
CID 134414944
2-N,4-N,4-N,6-tetramethyl-2-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidine-2,4-diamine
CID 53539526
N-[(2-Amino-1,3-thiazol-4-YL)methyl]-6-methyl-2-propylpyrimidin-4-amine
CID 50965012
6-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine
CID 61283435
5-fluoro-6-methyl-2-[(4-methyl-1,3-thiazol-2-yl)methyl]-N-propylpyrimidin-4-amine
CID 65997808
5-Fluoro-6-methyl-2-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine
CID 65999187
5-fluoro-N,6-dimethyl-2-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine
CID 65999593
5-Fluoro-6-methyl-2-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine
CID 65999971
5-fluoro-N,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine
CID 65999982
N-ethyl-5-fluoro-6-methyl-2-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine
CID 66000196

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine (CID 87886184) is 4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine is Cc1cc(Nc2nc(C)cs2)nc(S(C)=O)n1.
What is the InChIKey of 4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine?
The InChIKey is VKQPIBDUDQEMKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS2/c1-6-4-8(14-10(12-6)17(3)15)13-9-11-7(2)5-16-9/h4-5H,1-3H3,(H,11,12,13,14).
What are the key properties of 4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine?
4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine has a molecular weight of 268.37 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(6-methyl-2-methylsulfinylpyrimidin-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 87886184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).