N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide

C15H19N3OS — CID 43787391

IUPACN,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide
SMILESCNC(=O)c1ccc(C)c(NC(C)c2scnc2C)c1
InChIInChI=1S/C15H19N3OS/c1-9-5-6-12(15(19)16-4)7-13(9)18-11(3)14-10(2)17-8-20-14/h5-8,11,18H,1-4H3,(H,16,19)
InChIKeyADVJDIWDVHSFMI-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.29
Rot. Bonds4

About N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide

N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide (PubChem CID 43787391) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide.

Molecular Properties

Compound NameN,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide
PubChem CID43787391
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC NameN,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide
SMILESCNC(=O)c1ccc(C)c(NC(C)c2scnc2C)c1
InChIInChI=1S/C15H19N3OS/c1-9-5-6-12(15(19)16-4)7-13(9)18-11(3)14-10(2)17-8-20-14/h5-8,11,18H,1-4H3,(H,16,19)
InChIKeyADVJDIWDVHSFMI-UHFFFAOYSA-N
XLogP3.29
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide
CID 43789045
N-cyclopropyl-4-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide
CID 43781900
1-methyl-3-[4-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]phenyl]urea
CID 43790812
2,4,5-trichloro-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]aniline
CID 43759104
2-chloro-5-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]aniline
CID 103936659
2-chloro-5-fluoro-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]aniline
CID 107527119
2,4-difluoro-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]aniline
CID 43763933
4-[1-(2,5-dimethylfuran-3-yl)ethylamino]-N,3-dimethylbenzamide
CID 43740192
2-[2-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]phenyl]sulfanylacetamide
CID 43786501
4-methyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]-3-nitroaniline
CID 43785547
N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]aniline
CID 43756143
6-methyl-N-[2-methyl-5-(methylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 46439271

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide?
The IUPAC name of N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide (CID 43787391) is N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide.
What is the SMILES notation for N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide?
The canonical SMILES for N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide is CNC(=O)c1ccc(C)c(NC(C)c2scnc2C)c1.
What is the InChIKey of N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide?
The InChIKey is ADVJDIWDVHSFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-9-5-6-12(15(19)16-4)7-13(9)18-11(3)14-10(2)17-8-20-14/h5-8,11,18H,1-4H3,(H,16,19).
What are the key properties of N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide?
N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide has a molecular weight of 289.40 g/mol, XLogP of 3.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-3-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]benzamide is sourced from PubChem (CID 43787391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).