4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide

C16H14N4O2S — CID 75389227

IUPAC4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide
SMILESCOc1ccc(C(=O)Nc2nc(C)ns2)cc1-c1ccccn1
InChIInChI=1S/C16H14N4O2S/c1-10-18-16(23-20-10)19-15(21)11-6-7-14(22-2)12(9-11)13-5-3-4-8-17-13/h3-9H,1-2H3,(H,18,19,20,21)
InChIKeyDGMPZOQSOQXTCM-UHFFFAOYSA-N
MW326.38 g/mol
LogP3.17
Rot. Bonds4

About 4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide

4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide (PubChem CID 75389227) has the molecular formula C16H14N4O2S and a molecular weight of 326.38 g/mol. Its IUPAC name is 4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide
PubChem CID75389227
Molecular FormulaC16H14N4O2S
Molecular Weight326.38 g/mol
Exact Mass326.08
IUPAC Name4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide
SMILESCOc1ccc(C(=O)Nc2nc(C)ns2)cc1-c1ccccn1
InChIInChI=1S/C16H14N4O2S/c1-10-18-16(23-20-10)19-15(21)11-6-7-14(22-2)12(9-11)13-5-3-4-8-17-13/h3-9H,1-2H3,(H,18,19,20,21)
InChIKeyDGMPZOQSOQXTCM-UHFFFAOYSA-N
XLogP3.17
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 4-methoxy-3-pyridin-2-ylbenzoate
CID 70840507
4-methoxy-N-(5-methoxy-1,3-dimethylpyrazol-4-yl)-3-pyridin-2-ylbenzamide
CID 99576828
3-methoxy-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-4-propan-2-yloxybenzamide
CID 46511812
N-[1-(hydroxymethyl)cyclopentyl]-4-methoxy-3-pyridin-2-ylbenzamide
CID 110008383
3-(difluoromethoxy)-4-methoxy-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 46493268
N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide
CID 99718321
(2S,3S)-2-[(4-methoxy-3-pyridin-2-ylbenzoyl)amino]-3-methylpentanoic acid
CID 120517382
2-fluoro-N-(3-methyl-1,2,4-thiadiazol-5-yl)pyridine-4-carboxamide
CID 115661242
4-methoxy-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31154800
4-methoxy-3-nitro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 8924132
2-methoxy-N-(3-pyridin-2-yl-1,2,4-thiadiazol-5-yl)-4-(trifluoromethoxy)benzamide
CID 122555372
N-(4-hydroxy-2,2-dimethylpentyl)-4-methoxy-3-pyridin-2-ylbenzamide
CID 109399395

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide?
The IUPAC name of 4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide (CID 75389227) is 4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide.
What is the SMILES notation for 4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide?
The canonical SMILES for 4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide is COc1ccc(C(=O)Nc2nc(C)ns2)cc1-c1ccccn1.
What is the InChIKey of 4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide?
The InChIKey is DGMPZOQSOQXTCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2S/c1-10-18-16(23-20-10)19-15(21)11-6-7-14(22-2)12(9-11)13-5-3-4-8-17-13/h3-9H,1-2H3,(H,18,19,20,21).
What are the key properties of 4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide?
4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide has a molecular weight of 326.38 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide is sourced from PubChem (CID 75389227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).