2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride

C20H25ClN2O2 — CID 120829826

IUPAC2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride
SMILESCNC(C)CNC(=O)c1ccccc1C(=O)c1cc(C)ccc1C.Cl
InChIInChI=1S/C20H24N2O2.ClH/c1-13-9-10-14(2)18(11-13)19(23)16-7-5-6-8-17(16)20(24)22-12-15(3)21-4;/h5-11,15,21H,12H2,1-4H3,(H,22,24);1H
InChIKeyQQPKLDJDSRLGEV-UHFFFAOYSA-N
MW360.89 g/mol
LogP3.29
Rot. Bonds6

About 2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride

2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride (PubChem CID 120829826) has the molecular formula C20H25ClN2O2 and a molecular weight of 360.89 g/mol. Its IUPAC name is 2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride.

Molecular Properties

Compound Name2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride
PubChem CID120829826
Molecular FormulaC20H25ClN2O2
Molecular Weight360.89 g/mol
Exact Mass360.16
IUPAC Name2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride
SMILESCNC(C)CNC(=O)c1ccccc1C(=O)c1cc(C)ccc1C.Cl
InChIInChI=1S/C20H24N2O2.ClH/c1-13-9-10-14(2)18(11-13)19(23)16-7-5-6-8-17(16)20(24)22-12-15(3)21-4;/h5-11,15,21H,12H2,1-4H3,(H,22,24);1H
InChIKeyQQPKLDJDSRLGEV-UHFFFAOYSA-N
XLogP3.29
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.89
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-dimethylbenzoyl)-N-(2-hydroxypropyl)benzamide
CID 110886651
2-(2,5-dimethylbenzoyl)-N-[2-(methanesulfonamido)ethyl]benzamide
CID 39975858
5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide
CID 103512684
3-methyl-N-[2-(methylamino)propyl]-2-nitrobenzamide;hydrochloride
CID 120828085
2-fluoro-3-methyl-N-[2-(methylamino)propyl]benzamide
CID 103512650
N-[2-(methylamino)propyl]-2-[(3-methylbenzoyl)amino]benzamide;hydrochloride
CID 120827166
N-[2-(methylamino)propyl]-2-methylsulfanylbenzamide;hydrochloride
CID 120831488
2-methoxy-N-[2-(methylamino)propyl]benzamide
CID 103512789
(2,5-dimethylphenyl)-[2-[3-[2-(methylamino)propyl]-1,2,4-oxadiazol-5-yl]phenyl]methanone;hydrochloride
CID 120865027
2,5-dimethyl-N-[2-(methylamino)propyl]-1-pyridin-2-ylpyrrole-3-carboxamide;dihydrochloride
CID 120831614
N-(2-hydroxy-2-phenylethyl)-2,5-dimethylbenzamide
CID 43391272
N'-(2-bromobenzoyl)-2-(2,5-dimethylbenzoyl)benzohydrazide
CID 2439814

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride?
The IUPAC name of 2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride (CID 120829826) is 2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride.
What is the SMILES notation for 2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride?
The canonical SMILES for 2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride is CNC(C)CNC(=O)c1ccccc1C(=O)c1cc(C)ccc1C.Cl.
What is the InChIKey of 2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride?
The InChIKey is QQPKLDJDSRLGEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2.ClH/c1-13-9-10-14(2)18(11-13)19(23)16-7-5-6-8-17(16)20(24)22-12-15(3)21-4;/h5-11,15,21H,12H2,1-4H3,(H,22,24);1H.
What are the key properties of 2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride?
2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride has a molecular weight of 360.89 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride is sourced from PubChem (CID 120829826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).