3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride

C18H23ClN2O3 — CID 119437963

IUPAC3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride
SMILESCNCc1ccccc1NC(=O)c1cc(OC)c(C)c(OC)c1.Cl
InChIInChI=1S/C18H22N2O3.ClH/c1-12-16(22-3)9-14(10-17(12)23-4)18(21)20-15-8-6-5-7-13(15)11-19-2;/h5-10,19H,11H2,1-4H3,(H,20,21);1H
InChIKeyGWKRWMGVYBDRCD-UHFFFAOYSA-N
MW350.85 g/mol
LogP3.41
Rot. Bonds6

About 3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride

3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride (PubChem CID 119437963) has the molecular formula C18H23ClN2O3 and a molecular weight of 350.85 g/mol. Its IUPAC name is 3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride.

Molecular Properties

Compound Name3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride
PubChem CID119437963
Molecular FormulaC18H23ClN2O3
Molecular Weight350.85 g/mol
Exact Mass350.14
IUPAC Name3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride
SMILESCNCc1ccccc1NC(=O)c1cc(OC)c(C)c(OC)c1.Cl
InChIInChI=1S/C18H22N2O3.ClH/c1-12-16(22-3)9-14(10-17(12)23-4)18(21)20-15-8-6-5-7-13(15)11-19-2;/h5-10,19H,11H2,1-4H3,(H,20,21);1H
InChIKeyGWKRWMGVYBDRCD-UHFFFAOYSA-N
XLogP3.41
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.85
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dimethyl-N-[2-(methylaminomethyl)phenyl]benzamide
CID 43601073
3,4-diethoxy-N-[2-(methylaminomethyl)phenyl]benzamide
CID 119437877
3-hydroxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide
CID 43600945
N-(2-ethylphenyl)-3-methoxy-4-methylbenzamide
CID 16620352
N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxy-4-methylbenzamide
CID 2669248
4-fluoro-3-methyl-N-[2-(methylaminomethyl)phenyl]benzamide
CID 63213814
3,4-dichloro-N-[2-(methylaminomethyl)phenyl]benzamide
CID 43600909
4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide
CID 43601035
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide
CID 119438730
2-bromo-5-methoxy-N-[2-(methylaminomethyl)phenyl]benzamide
CID 43600896
N-[2-(ethylaminomethyl)phenyl]-3,4-dimethoxy-5-prop-2-enylbenzamide
CID 119440133
N-[2-(ethylaminomethyl)phenyl]-3-methoxy-4-[2-(methylamino)-2-oxoethoxy]benzamide
CID 119439139

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride?
The IUPAC name of 3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride (CID 119437963) is 3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride.
What is the SMILES notation for 3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride?
The canonical SMILES for 3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride is CNCc1ccccc1NC(=O)c1cc(OC)c(C)c(OC)c1.Cl.
What is the InChIKey of 3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride?
The InChIKey is GWKRWMGVYBDRCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3.ClH/c1-12-16(22-3)9-14(10-17(12)23-4)18(21)20-15-8-6-5-7-13(15)11-19-2;/h5-10,19H,11H2,1-4H3,(H,20,21);1H.
What are the key properties of 3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride?
3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride has a molecular weight of 350.85 g/mol, XLogP of 3.41, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide;hydrochloride is sourced from PubChem (CID 119437963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).