N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide

C18H17N3OS — CID 22049767

IUPACN,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide
SMILESCNC(=O)c1ccc(C)c(-c2nc(-c3cnccc3C)cs2)c1
InChIInChI=1S/C18H17N3OS/c1-11-4-5-13(17(22)19-3)8-14(11)18-21-16(10-23-18)15-9-20-7-6-12(15)2/h4-10H,1-3H3,(H,19,22)
InChIKeyPUQAQLOALYNWTJ-UHFFFAOYSA-N
MW323.42 g/mol
LogP3.85
Rot. Bonds3

About N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide

N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide (PubChem CID 22049767) has the molecular formula C18H17N3OS and a molecular weight of 323.42 g/mol. Its IUPAC name is N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide.

Molecular Properties

Compound NameN,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide
PubChem CID22049767
Molecular FormulaC18H17N3OS
Molecular Weight323.42 g/mol
Exact Mass323.11
IUPAC NameN,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide
SMILESCNC(=O)c1ccc(C)c(-c2nc(-c3cnccc3C)cs2)c1
InChIInChI=1S/C18H17N3OS/c1-11-4-5-13(17(22)19-3)8-14(11)18-21-16(10-23-18)15-9-20-7-6-12(15)2/h4-10H,1-3H3,(H,19,22)
InChIKeyPUQAQLOALYNWTJ-UHFFFAOYSA-N
XLogP3.85
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.42
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide with MolForge

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

Launch Full Analysis

Related Compounds

4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole
CID 22049802
4-[2-(4-methyl-3-pyridinyl)-1,3-thiazol-4-yl]benzamide
CID 22049680
2-(2-chlorophenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
CID 91378887
2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
CID 91135598
2-methoxy-N-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]pyrimidine-5-carboxamide
CID 162387055
4-(2,4-dichlorophenyl)-2-(4-methyl-3-pyridinyl)-1,3-thiazole;hydrochloride
CID 67551034
N-methyl-4-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 1483692
2-(2,3-dihydro-1-benzofuran-5-yl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
CID 91013706
N-methyl-3-(2-methyl-1,3-thiazol-4-yl)benzamide
CID 70899033
3,4-dimethyl-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 90626115
N-[2-methyl-1-[3-(4-methyl-3-pyridinyl)-1,2,4-oxadiazol-5-yl]propyl]acetamide
CID 45235273
4-[(4,6-dimethylpyrimidin-2-yl)amino]-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]benzamide
CID 108748089

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide?
The IUPAC name of N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide (CID 22049767) is N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide.
What is the SMILES notation for N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide?
The canonical SMILES for N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide is CNC(=O)c1ccc(C)c(-c2nc(-c3cnccc3C)cs2)c1.
What is the InChIKey of N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide?
The InChIKey is PUQAQLOALYNWTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3OS/c1-11-4-5-13(17(22)19-3)8-14(11)18-21-16(10-23-18)15-9-20-7-6-12(15)2/h4-10H,1-3H3,(H,19,22).
What are the key properties of N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide?
N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide has a molecular weight of 323.42 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-3-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]benzamide is sourced from PubChem (CID 22049767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).