2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride

C19H25ClN2O — CID 119945788

IUPAC2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride
SMILESCc1ccc(C(C)(C)CN(C)C(=O)c2ccccc2N)cc1.Cl
InChIInChI=1S/C19H24N2O.ClH/c1-14-9-11-15(12-10-14)19(2,3)13-21(4)18(22)16-7-5-6-8-17(16)20;/h5-12H,13,20H2,1-4H3;1H
InChIKeyHWCAQFZVOTXFRD-UHFFFAOYSA-N
MW332.88 g/mol
LogP4.05
Rot. Bonds4

About 2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride

2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride (PubChem CID 119945788) has the molecular formula C19H25ClN2O and a molecular weight of 332.88 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride
PubChem CID119945788
Molecular FormulaC19H25ClN2O
Molecular Weight332.88 g/mol
Exact Mass332.17
IUPAC Name2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride
SMILESCc1ccc(C(C)(C)CN(C)C(=O)c2ccccc2N)cc1.Cl
InChIInChI=1S/C19H24N2O.ClH/c1-14-9-11-15(12-10-14)19(2,3)13-21(4)18(22)16-7-5-6-8-17(16)20;/h5-12H,13,20H2,1-4H3;1H
InChIKeyHWCAQFZVOTXFRD-UHFFFAOYSA-N
XLogP4.05
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.88
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-N,2-dimethyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride
CID 120636434
3-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]butanamide;hydrochloride
CID 119805929
3-amino-2-bromo-N-(2-hydroxy-2-methylpropyl)-N-methylbenzamide
CID 113367038
N-(2-hydroxy-2-methylpropyl)-N-methyl-2-(4-methylbenzoyl)benzamide
CID 111697880
2-amino-N-tert-butyl-N-ethylbenzamide
CID 15894058
2-amino-N-[(2-bromophenyl)methyl]-N-methylbenzamide
CID 55028935
N-(3-amino-2,2-dimethylpropyl)-N,2-dimethylbenzamide
CID 79652872
2-amino-N-methyl-N-[3-(2-methylphenoxy)propyl]benzamide;hydrochloride
CID 119944826
2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride
CID 119946092
2-amino-N-methyl-N-[(1-methylpiperidin-3-yl)methyl]benzamide;dihydrochloride
CID 119946678
2-amino-N-(2-cyclohexylethyl)-N-methylbenzamide
CID 119945212
2-amino-N-(3-methoxypropyl)-N-methylbenzamide
CID 62983937

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride?
The IUPAC name of 2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride (CID 119945788) is 2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride.
What is the SMILES notation for 2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride?
The canonical SMILES for 2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride is Cc1ccc(C(C)(C)CN(C)C(=O)c2ccccc2N)cc1.Cl.
What is the InChIKey of 2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride?
The InChIKey is HWCAQFZVOTXFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O.ClH/c1-14-9-11-15(12-10-14)19(2,3)13-21(4)18(22)16-7-5-6-8-17(16)20;/h5-12H,13,20H2,1-4H3;1H.
What are the key properties of 2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride?
2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride has a molecular weight of 332.88 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-[2-methyl-2-(4-methylphenyl)propyl]benzamide;hydrochloride is sourced from PubChem (CID 119945788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).