N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide

C11H12N4OS — CID 58236280

IUPACN,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide
SMILESCc1nc(-c2cncnc2)sc1C(=O)N(C)C
InChIInChI=1S/C11H12N4OS/c1-7-9(11(16)15(2)3)17-10(14-7)8-4-12-6-13-5-8/h4-6H,1-3H3
InChIKeySMFBSPDUBUEZGN-UHFFFAOYSA-N
MW248.31 g/mol
LogP1.61
Rot. Bonds2

About N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide

N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide (PubChem CID 58236280) has the molecular formula C11H12N4OS and a molecular weight of 248.31 g/mol. Its IUPAC name is N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide
PubChem CID58236280
Molecular FormulaC11H12N4OS
Molecular Weight248.31 g/mol
Exact Mass248.07
IUPAC NameN,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide
SMILESCc1nc(-c2cncnc2)sc1C(=O)N(C)C
InChIInChI=1S/C11H12N4OS/c1-7-9(11(16)15(2)3)17-10(14-7)8-4-12-6-13-5-8/h4-6H,1-3H3
InChIKeySMFBSPDUBUEZGN-UHFFFAOYSA-N
XLogP1.61
TPSA58.98 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide (CID 58236280) is N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide is Cc1nc(-c2cncnc2)sc1C(=O)N(C)C.
What is the InChIKey of N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide?
The InChIKey is SMFBSPDUBUEZGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4OS/c1-7-9(11(16)15(2)3)17-10(14-7)8-4-12-6-13-5-8/h4-6H,1-3H3.
What are the key properties of N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide?
N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide has a molecular weight of 248.31 g/mol, XLogP of 1.61, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-2-pyrimidin-5-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 58236280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).