N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide

C13H16N4OS — CID 79829668

IUPACN,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(NCCc2cscn2)nc1
InChIInChI=1S/C13H16N4OS/c1-17(2)13(18)10-3-4-12(15-7-10)14-6-5-11-8-19-9-16-11/h3-4,7-9H,5-6H2,1-2H3,(H,14,15)
InChIKeyWCIKWFCZFXDMSX-UHFFFAOYSA-N
MW276.37 g/mol
LogP1.89
Rot. Bonds5

About N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide

N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide (PubChem CID 79829668) has the molecular formula C13H16N4OS and a molecular weight of 276.37 g/mol. Its IUPAC name is N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide
PubChem CID79829668
Molecular FormulaC13H16N4OS
Molecular Weight276.37 g/mol
Exact Mass276.10
IUPAC NameN,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(NCCc2cscn2)nc1
InChIInChI=1S/C13H16N4OS/c1-17(2)13(18)10-3-4-12(15-7-10)14-6-5-11-8-19-9-16-11/h3-4,7-9H,5-6H2,1-2H3,(H,14,15)
InChIKeyWCIKWFCZFXDMSX-UHFFFAOYSA-N
XLogP1.89
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.37
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carbothioamide
CID 63826078
N,N-dimethyl-6-[2-(5-methyl-1,3-thiazol-2-yl)ethylamino]pyridine-3-carboxamide
CID 133323231
5-tert-butyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyridin-2-amine
CID 107874695
6-[2-(4-fluorophenyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 78956160
N,N-dimethyl-6-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyridine-3-carboxamide
CID 103744306
6-(6-hydroxyhexylamino)-N,N-dimethylpyridine-3-carboxamide
CID 103918113
6-[2-(cyclopenten-1-yl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 103844277
4-fluoro-N,N-dimethyl-3-[2-(1,3-thiazol-4-yl)ethylcarbamoylamino]benzamide
CID 84589657
N,N-dimethyl-6-(5,5,5-trifluoropentylamino)pyridine-3-carboxamide
CID 115486588
N,N-dimethyl-6-[2-(2,2,2-trifluoroethoxy)ethylamino]pyridine-3-carboxamide
CID 78956359
6-[2-(2-amino-2-oxoethoxy)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 106239261
6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 103918035

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide?
The IUPAC name of N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide (CID 79829668) is N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide?
The canonical SMILES for N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide is CN(C)C(=O)c1ccc(NCCc2cscn2)nc1.
What is the InChIKey of N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide?
The InChIKey is WCIKWFCZFXDMSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4OS/c1-17(2)13(18)10-3-4-12(15-7-10)14-6-5-11-8-19-9-16-11/h3-4,7-9H,5-6H2,1-2H3,(H,14,15).
What are the key properties of N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide?
N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide has a molecular weight of 276.37 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[2-(1,3-thiazol-4-yl)ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 79829668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).