5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine

C8H9N5S — CID 155315751

IUPAC5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1-c1ccnc(N)n1
InChIInChI=1S/C8H9N5S/c1-4-6(14-8(10)12-4)5-2-3-11-7(9)13-5/h2-3H,1H3,(H2,10,12)(H2,9,11,13)
InChIKeyJPXZDHWPWCZKAT-UHFFFAOYSA-N
MW207.26 g/mol
LogP1.07
Rot. Bonds1

About 5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine

5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine (PubChem CID 155315751) has the molecular formula C8H9N5S and a molecular weight of 207.26 g/mol. Its IUPAC name is 5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine
PubChem CID155315751
Molecular FormulaC8H9N5S
Molecular Weight207.26 g/mol
Exact Mass207.06
IUPAC Name5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1-c1ccnc(N)n1
InChIInChI=1S/C8H9N5S/c1-4-6(14-8(10)12-4)5-2-3-11-7(9)13-5/h2-3H,1H3,(H2,10,12)(H2,9,11,13)
InChIKeyJPXZDHWPWCZKAT-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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Frequently Asked Questions

What is the IUPAC name of 5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine (CID 155315751) is 5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine is Cc1nc(N)sc1-c1ccnc(N)n1.
What is the InChIKey of 5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine?
The InChIKey is JPXZDHWPWCZKAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5S/c1-4-6(14-8(10)12-4)5-2-3-11-7(9)13-5/h2-3H,1H3,(H2,10,12)(H2,9,11,13).
What are the key properties of 5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine?
5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine 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 5-(2-aminopyrimidin-4-yl)-4-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 155315751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).