4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine

C11H14N4S — CID 6539279

IUPAC4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine
SMILESCc1nc(C)c(-c2ccnc(N(C)C)n2)s1
InChIInChI=1S/C11H14N4S/c1-7-10(16-8(2)13-7)9-5-6-12-11(14-9)15(3)4/h5-6H,1-4H3
InChIKeyOXXITOAERUPUMS-UHFFFAOYSA-N
MW234.33 g/mol
LogP2.28
Rot. Bonds2

About 4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine

4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine (PubChem CID 6539279) has the molecular formula C11H14N4S and a molecular weight of 234.33 g/mol. Its IUPAC name is 4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine
PubChem CID6539279
Molecular FormulaC11H14N4S
Molecular Weight234.33 g/mol
Exact Mass234.09
IUPAC Name4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine
SMILESCc1nc(C)c(-c2ccnc(N(C)C)n2)s1
InChIInChI=1S/C11H14N4S/c1-7-10(16-8(2)13-7)9-5-6-12-11(14-9)15(3)4/h5-6H,1-4H3
InChIKeyOXXITOAERUPUMS-UHFFFAOYSA-N
XLogP2.28
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.33
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine?
The IUPAC name of 4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine (CID 6539279) is 4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine.
What is the SMILES notation for 4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine?
The canonical SMILES for 4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine is Cc1nc(C)c(-c2ccnc(N(C)C)n2)s1.
What is the InChIKey of 4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine?
The InChIKey is OXXITOAERUPUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4S/c1-7-10(16-8(2)13-7)9-5-6-12-11(14-9)15(3)4/h5-6H,1-4H3.
What are the key properties of 4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine?
4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine has a molecular weight of 234.33 g/mol, XLogP of 2.28, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethyl-1,3-thiazol-5-yl)-N,N-dimethylpyrimidin-2-amine is sourced from PubChem (CID 6539279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).