3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride

C15H17ClN2O3 — CID 163326261

IUPAC3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride
SMILESCOc1ccc(C(=O)Nc2ccc(C)cn2)cc1OC.Cl
InChIInChI=1S/C15H16N2O3.ClH/c1-10-4-7-14(16-9-10)17-15(18)11-5-6-12(19-2)13(8-11)20-3;/h4-9H,1-3H3,(H,16,17,18);1H
InChIKeyWMBIOCOEVCRRTH-UHFFFAOYSA-N
MW308.77 g/mol
LogP3.08
Rot. Bonds4

About 3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride

3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride (PubChem CID 163326261) has the molecular formula C15H17ClN2O3 and a molecular weight of 308.77 g/mol. Its IUPAC name is 3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride.

Molecular Properties

Compound Name3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride
PubChem CID163326261
Molecular FormulaC15H17ClN2O3
Molecular Weight308.77 g/mol
Exact Mass308.09
IUPAC Name3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride
SMILESCOc1ccc(C(=O)Nc2ccc(C)cn2)cc1OC.Cl
InChIInChI=1S/C15H16N2O3.ClH/c1-10-4-7-14(16-9-10)17-15(18)11-5-6-12(19-2)13(8-11)20-3;/h4-9H,1-3H3,(H,16,17,18);1H
InChIKeyWMBIOCOEVCRRTH-UHFFFAOYSA-N
XLogP3.08
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.77
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyano-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide
CID 143484074
N-(5-amino-2-pyridinyl)-3,4-dimethoxybenzamide
CID 43144619
3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide
CID 18106773
3-chloro-4,5-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide
CID 17395012
3,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzamide
CID 113023443
N-[5-(2,6-dimethylanilino)-2-pyridinyl]-3,4-dimethoxybenzamide
CID 113032261
methyl 3-[(5-methyl-2-pyridinyl)carbamoyl]benzoate
CID 108799744
3,4-dimethoxy-N-[5-[(3-methylphenyl)methylamino]-2-pyridinyl]benzamide
CID 113026605
4-bromo-3-methyl-N-(5-methyl-2-pyridinyl)benzamide
CID 113338779
N-(5-chloro-2-pyridinyl)-3-methoxy-4-methylbenzamide
CID 47122719
3-bromo-N-(5-bromo-2-pyridinyl)-4-methoxybenzamide
CID 23935414
3,4-dimethoxy-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide
CID 110402230

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride?
The IUPAC name of 3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride (CID 163326261) is 3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride.
What is the SMILES notation for 3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride?
The canonical SMILES for 3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride is COc1ccc(C(=O)Nc2ccc(C)cn2)cc1OC.Cl.
What is the InChIKey of 3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride?
The InChIKey is WMBIOCOEVCRRTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3.ClH/c1-10-4-7-14(16-9-10)17-15(18)11-5-6-12(19-2)13(8-11)20-3;/h4-9H,1-3H3,(H,16,17,18);1H.
What are the key properties of 3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride?
3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride has a molecular weight of 308.77 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride is sourced from PubChem (CID 163326261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).