N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide

C15H13N3O2S — CID 56592910

IUPACN-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide
SMILESCOc1ccc(C)c2sc(NC(=O)c3ccncc3)nc12
InChIInChI=1S/C15H13N3O2S/c1-9-3-4-11(20-2)12-13(9)21-15(17-12)18-14(19)10-5-7-16-8-6-10/h3-8H,1-2H3,(H,17,18,19)
InChIKeyMADRUEVBYJEFFT-UHFFFAOYSA-N
MW299.36 g/mol
LogP3.26
Rot. Bonds3

About N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide

N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide (PubChem CID 56592910) has the molecular formula C15H13N3O2S and a molecular weight of 299.36 g/mol. Its IUPAC name is N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide
PubChem CID56592910
Molecular FormulaC15H13N3O2S
Molecular Weight299.36 g/mol
Exact Mass299.07
IUPAC NameN-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide
SMILESCOc1ccc(C)c2sc(NC(=O)c3ccncc3)nc12
InChIInChI=1S/C15H13N3O2S/c1-9-3-4-11(20-2)12-13(9)21-15(17-12)18-14(19)10-5-7-16-8-6-10/h3-8H,1-2H3,(H,17,18,19)
InChIKeyMADRUEVBYJEFFT-UHFFFAOYSA-N
XLogP3.26
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide 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

N-(4-5-methoxy-7-2-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide
CID 56592940
N-(4-ethoxybenzo[d]thiazol-2-yl)-N-(pyridin-3-ylmethyl)cyclohexanecarboxamide
CID 16032335
4-cyano-N-(4-methoxy-7-methylbenzo[d]thiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide
CID 40481904
N-[6-(6-amino-5-methoxy-3-pyridinyl)-1,3-benzothiazol-2-yl]acetamide
CID 59251848
N-[6-(5-methoxy-3-pyridinyl)-1,3-benzothiazol-2-yl]acetamide
CID 89034287
N-(6-methoxybenzo[d]thiazol-2-yl)-4-nicotinoylbenzamide
CID 117940931
N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(pyridine-2-carbonyl)benzamide
CID 117941010
N-(4-Methoxy-1,3-benzothiazol-2-yl)benzamide
CID 569599
N-(6-ethoxy-1,3-benzothiazol-2-yl)nicotinamide
CID 849590
3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)benzamide
CID 7172926
2,3-dimethoxy-N-(4-methoxy-7-methylbenzo[d]thiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide
CID 16032549
N-[2-(Dimethylamino)ethyl]-3-(2,5-dioxopyrrolidin-1-YL)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-YL)benzamide hydrochloride
CID 24892359

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide?
The IUPAC name of N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide (CID 56592910) is N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide?
The canonical SMILES for N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide is COc1ccc(C)c2sc(NC(=O)c3ccncc3)nc12.
What is the InChIKey of N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide?
The InChIKey is MADRUEVBYJEFFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2S/c1-9-3-4-11(20-2)12-13(9)21-15(17-12)18-14(19)10-5-7-16-8-6-10/h3-8H,1-2H3,(H,17,18,19).
What are the key properties of N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide?
N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide has a molecular weight of 299.36 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 56592910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).