6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine

C8H9N5S — CID 130752211

IUPAC6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine
SMILESCc1cc(-c2cc(N)nc(N)n2)sn1
InChIInChI=1S/C8H9N5S/c1-4-2-6(14-13-4)5-3-7(9)12-8(10)11-5/h2-3H,1H3,(H4,9,10,11,12)
InChIKeyLSZUDTRVITVCFS-UHFFFAOYSA-N
MW207.26 g/mol
LogP1.07
Rot. Bonds1

About 6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine

6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine (PubChem CID 130752211) has the molecular formula C8H9N5S and a molecular weight of 207.26 g/mol. Its IUPAC name is 6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine
PubChem CID130752211
Molecular FormulaC8H9N5S
Molecular Weight207.26 g/mol
Exact Mass207.06
IUPAC Name6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine
SMILESCc1cc(-c2cc(N)nc(N)n2)sn1
InChIInChI=1S/C8H9N5S/c1-4-2-6(14-13-4)5-3-7(9)12-8(10)11-5/h2-3H,1H3,(H4,9,10,11,12)
InChIKeyLSZUDTRVITVCFS-UHFFFAOYSA-N
XLogP1.07
TPSA90.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(3-methyl-1,2-thiazol-5-yl)-1,2,4-triazin-3-amine
CID 82402081
3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole
CID 134094530
[6-(3-methyl-1,2-thiazol-5-yl)pyridazin-3-yl]methanamine
CID 159756534
formic acid;6-methylpyrimidine-2,4-diamine
CID 175141048
4,6-dimethylpyrimidin-2-amine;hydrochloride
CID 140629054
5-methyl-3-(3-methyl-1,2-thiazol-5-yl)pyridin-2-amine
CID 130641777
2,4-diamino-6-[2-(3-methyl-1,2-thiazol-5-yl)phenyl]pyrimidine-5-carbonitrile
CID 169397583
4-(5-iodothiophen-2-yl)-6-methylpyrimidin-2-amine
CID 53426321
6-(2-methyl-1,3-benzothiazol-5-yl)pyrimidine-2,4-diamine
CID 155910091
2,4-diamino-6-[3-(3-methyl-1,2-thiazol-5-yl)phenyl]pyrimidine-5-carbonitrile
CID 169397582
6-(4-tert-butylphenyl)pyrimidine-2,4-diamine
CID 106878479
ethane;3-methyl-5-phenyl-1,2-thiazole
CID 142845689

Frequently Asked Questions

What is the IUPAC name of 6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine?
The IUPAC name of 6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine (CID 130752211) is 6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine.
What is the SMILES notation for 6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine?
The canonical SMILES for 6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine is Cc1cc(-c2cc(N)nc(N)n2)sn1.
What is the InChIKey of 6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine?
The InChIKey is LSZUDTRVITVCFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5S/c1-4-2-6(14-13-4)5-3-7(9)12-8(10)11-5/h2-3H,1H3,(H4,9,10,11,12).
What are the key properties of 6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine?
6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine has a molecular weight of 207.26 g/mol, XLogP of 1.07, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methyl-1,2-thiazol-5-yl)pyrimidine-2,4-diamine is sourced from PubChem (CID 130752211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).