N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride

C18H22Cl2N2O2 — CID 119997645

IUPACN-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride
SMILESCC(CN)CNC(=O)c1ccccc1OCc1ccccc1Cl.Cl
InChIInChI=1S/C18H21ClN2O2.ClH/c1-13(10-20)11-21-18(22)15-7-3-5-9-17(15)23-12-14-6-2-4-8-16(14)19;/h2-9,13H,10-12,20H2,1H3,(H,21,22);1H
InChIKeyBNAMMWIDXPKHND-UHFFFAOYSA-N
MW369.29 g/mol
LogP3.67
Rot. Bonds7

About N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride

N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride (PubChem CID 119997645) has the molecular formula C18H22Cl2N2O2 and a molecular weight of 369.29 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride
PubChem CID119997645
Molecular FormulaC18H22Cl2N2O2
Molecular Weight369.29 g/mol
Exact Mass368.11
IUPAC NameN-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride
SMILESCC(CN)CNC(=O)c1ccccc1OCc1ccccc1Cl.Cl
InChIInChI=1S/C18H21ClN2O2.ClH/c1-13(10-20)11-21-18(22)15-7-3-5-9-17(15)23-12-14-6-2-4-8-16(14)19;/h2-9,13H,10-12,20H2,1H3,(H,21,22);1H
InChIKeyBNAMMWIDXPKHND-UHFFFAOYSA-N
XLogP3.67
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.29
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2-methylpropyl)-2-chlorobenzamide;hydrochloride
CID 119998030
(2-chlorophenyl)methyl 2-[(2-ethoxybenzoyl)amino]acetate
CID 7951719
2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
CID 26901785
N-[1-[4-(carbamoylamino)phenyl]ethyl]-2-[(2-chlorophenyl)methoxy]benzamide
CID 60556484
1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one
CID 29287743
N-(3-amino-2-methylpropyl)-2-methylbenzamide
CID 62666683
2-[(2-chlorophenyl)methoxy]-N,N-diethylbenzamide
CID 13073609
N-[(3-carbamoylphenyl)methyl]-2-[(2-chlorophenyl)methoxy]benzamide
CID 32636545
2-[(2-chlorophenyl)methoxy]-N-[[4-(methylsulfamoyl)phenyl]methyl]benzamide
CID 46463772
2-[(2-chlorophenyl)methoxy]-N'-(2,3,4,5,6-pentafluorophenyl)benzohydrazide
CID 26886312
N-(3-amino-2-methylpropyl)-5-chloro-2-propoxybenzamide;hydrochloride
CID 119996312
2-chloro-4-[[2-[(2-chlorophenyl)methoxy]benzoyl]amino]-N-(2-methoxyethyl)benzamide
CID 60532900

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride?
The IUPAC name of N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride (CID 119997645) is N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride?
The canonical SMILES for N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride is CC(CN)CNC(=O)c1ccccc1OCc1ccccc1Cl.Cl.
What is the InChIKey of N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride?
The InChIKey is BNAMMWIDXPKHND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O2.ClH/c1-13(10-20)11-21-18(22)15-7-3-5-9-17(15)23-12-14-6-2-4-8-16(14)19;/h2-9,13H,10-12,20H2,1H3,(H,21,22);1H.
What are the key properties of N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride?
N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride has a molecular weight of 369.29 g/mol, XLogP of 3.67, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride is sourced from PubChem (CID 119997645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).