2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide

C10H12N6OS — CID 90643549

IUPAC2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide
SMILESCN(C)c1nc(-c2ccnc(N)n2)sc1C(N)=O
InChIInChI=1S/C10H12N6OS/c1-16(2)8-6(7(11)17)18-9(15-8)5-3-4-13-10(12)14-5/h3-4H,1-2H3,(H2,11,17)(H2,12,13,14)
InChIKeyAMZPDXTVDDMRNP-UHFFFAOYSA-N
MW264.31 g/mol
LogP0.35
Rot. Bonds3

About 2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide

2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide (PubChem CID 90643549) has the molecular formula C10H12N6OS and a molecular weight of 264.31 g/mol. Its IUPAC name is 2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide
PubChem CID90643549
Molecular FormulaC10H12N6OS
Molecular Weight264.31 g/mol
Exact Mass264.08
IUPAC Name2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide
SMILESCN(C)c1nc(-c2ccnc(N)n2)sc1C(N)=O
InChIInChI=1S/C10H12N6OS/c1-16(2)8-6(7(11)17)18-9(15-8)5-3-4-13-10(12)14-5/h3-4H,1-2H3,(H2,11,17)(H2,12,13,14)
InChIKeyAMZPDXTVDDMRNP-UHFFFAOYSA-N
XLogP0.35
TPSA111.02 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide (CID 90643549) is 2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide is CN(C)c1nc(-c2ccnc(N)n2)sc1C(N)=O.
What is the InChIKey of 2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide?
The InChIKey is AMZPDXTVDDMRNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6OS/c1-16(2)8-6(7(11)17)18-9(15-8)5-3-4-13-10(12)14-5/h3-4H,1-2H3,(H2,11,17)(H2,12,13,14).
What are the key properties of 2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide?
2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide has a molecular weight of 264.31 g/mol, XLogP of 0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminopyrimidin-4-yl)-4-(dimethylamino)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 90643549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).