N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride

C11H16Cl2N2O — CID 119998030

IUPACN-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride
SMILESCC(CN)CNC(=O)c1ccccc1Cl.Cl
InChIInChI=1S/C11H15ClN2O.ClH/c1-8(6-13)7-14-11(15)9-4-2-3-5-10(9)12;/h2-5,8H,6-7,13H2,1H3,(H,14,15);1H
InChIKeyQATRHXHTNAAXJX-UHFFFAOYSA-N
MW263.17 g/mol
LogP2.09
Rot. Bonds4

About N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride

N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride (PubChem CID 119998030) has the molecular formula C11H16Cl2N2O and a molecular weight of 263.17 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride
PubChem CID119998030
Molecular FormulaC11H16Cl2N2O
Molecular Weight263.17 g/mol
Exact Mass262.06
IUPAC NameN-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride
SMILESCC(CN)CNC(=O)c1ccccc1Cl.Cl
InChIInChI=1S/C11H15ClN2O.ClH/c1-8(6-13)7-14-11(15)9-4-2-3-5-10(9)12;/h2-5,8H,6-7,13H2,1H3,(H,14,15);1H
InChIKeyQATRHXHTNAAXJX-UHFFFAOYSA-N
XLogP2.09
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.17
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-amino-2-methylpropyl)-2-methylbenzamide
CID 62666683
N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride
CID 119997645
2-chloro-N-(4-chloro-2-methylbutyl)benzamide
CID 114306157
N-(3-amino-2-methylpropyl)-2-(methanesulfonamido)benzamide;hydrochloride
CID 119996445
N-(3-amino-2-methylpropyl)-3-iodo-2-methylbenzamide;hydrochloride
CID 119998328
N-(3-amino-2-methylpropyl)-2-ethylsulfonylbenzamide
CID 119997396
N-(3-amino-2-methylpropyl)-4-chlorobenzamide;hydrochloride
CID 119996366
N-(3-amino-2-methylpropyl)-2,4-dichloro-5-methylsulfanylbenzamide;hydrochloride
CID 119996337
N-(3-amino-2-methylpropyl)-2-propylsulfonylbenzamide
CID 119995898
N-(3-amino-2-methylpropyl)-3,4-dichlorobenzamide
CID 115267427
N-(3-amino-2-methylpropyl)-1-benzothiophene-3-carboxamide
CID 115271656
N-(3-amino-2-methylpropyl)-2-chloro-5-(3-methylbutanoylamino)benzamide;hydrochloride
CID 119997159

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride?
The IUPAC name of N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride (CID 119998030) is N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride?
The canonical SMILES for N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride is CC(CN)CNC(=O)c1ccccc1Cl.Cl.
What is the InChIKey of N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride?
The InChIKey is QATRHXHTNAAXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O.ClH/c1-8(6-13)7-14-11(15)9-4-2-3-5-10(9)12;/h2-5,8H,6-7,13H2,1H3,(H,14,15);1H.
What are the key properties of N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride?
N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride has a molecular weight of 263.17 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride is sourced from PubChem (CID 119998030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).