N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide

C15H19N3OS — CID 60936738

IUPACN-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide
SMILESCCNC(=O)c1ccc(C)c(NCc2cnc(C)s2)c1
InChIInChI=1S/C15H19N3OS/c1-4-16-15(19)12-6-5-10(2)14(7-12)18-9-13-8-17-11(3)20-13/h5-8,18H,4,9H2,1-3H3,(H,16,19)
InChIKeyJQEYKKYKLOPYLJ-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.12
Rot. Bonds5

About N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide

N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide (PubChem CID 60936738) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide.

Molecular Properties

Compound NameN-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide
PubChem CID60936738
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC NameN-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide
SMILESCCNC(=O)c1ccc(C)c(NCc2cnc(C)s2)c1
InChIInChI=1S/C15H19N3OS/c1-4-16-15(19)12-6-5-10(2)14(7-12)18-9-13-8-17-11(3)20-13/h5-8,18H,4,9H2,1-3H3,(H,16,19)
InChIKeyJQEYKKYKLOPYLJ-UHFFFAOYSA-N
XLogP3.12
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]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

5-fluoro-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]aniline
CID 60941542
5-chloro-2-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]aniline
CID 60941064
N-ethyl-4-methyl-3-(pyrimidin-4-ylmethylamino)benzamide
CID 62748907
3-[(4-cyanothiophen-2-yl)methylamino]-N-ethyl-4-methylbenzamide
CID 79611702
N-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]-4-nitrobenzamide
CID 82992841
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-6-(propylamino)pyridine-3-carboxamide
CID 62176173
4-(ethylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]quinazoline-7-carboxamide
CID 138034199
N-ethyl-4-methyl-3-[(1-methyltriazol-4-yl)methylamino]benzamide
CID 62757049
3-acetamido-N-ethyl-4-methylbenzamide
CID 47211029
N-methyl-4-[(2-methyl-1,3-thiazol-5-yl)methylamino]-3-nitrobenzamide
CID 78970979
4-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]benzamide
CID 39855026
4-[(2-chloro-1,3-thiazol-5-yl)methylamino]-N-(2-methoxyethyl)-3-methylbenzamide
CID 168583889

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide?
The IUPAC name of N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide (CID 60936738) is N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide.
What is the SMILES notation for N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide?
The canonical SMILES for N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide is CCNC(=O)c1ccc(C)c(NCc2cnc(C)s2)c1.
What is the InChIKey of N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide?
The InChIKey is JQEYKKYKLOPYLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-4-16-15(19)12-6-5-10(2)14(7-12)18-9-13-8-17-11(3)20-13/h5-8,18H,4,9H2,1-3H3,(H,16,19).
What are the key properties of N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide?
N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide has a molecular weight of 289.40 g/mol, XLogP of 3.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzamide is sourced from PubChem (CID 60936738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).