N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride

C19H25ClN2O3 — CID 119549073

IUPACN-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride
SMILESCCOCCOc1ccccc1C(=O)NCCc1ccc(N)cc1.Cl
InChIInChI=1S/C19H24N2O3.ClH/c1-2-23-13-14-24-18-6-4-3-5-17(18)19(22)21-12-11-15-7-9-16(20)10-8-15;/h3-10H,2,11-14,20H2,1H3,(H,21,22);1H
InChIKeyCOVKYCSBYVABMW-UHFFFAOYSA-N
MW364.87 g/mol
LogP3.08
Rot. Bonds9

About N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride

N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride (PubChem CID 119549073) has the molecular formula C19H25ClN2O3 and a molecular weight of 364.87 g/mol. Its IUPAC name is N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride
PubChem CID119549073
Molecular FormulaC19H25ClN2O3
Molecular Weight364.87 g/mol
Exact Mass364.16
IUPAC NameN-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride
SMILESCCOCCOc1ccccc1C(=O)NCCc1ccc(N)cc1.Cl
InChIInChI=1S/C19H24N2O3.ClH/c1-2-23-13-14-24-18-6-4-3-5-17(18)19(22)21-12-11-15-7-9-16(20)10-8-15;/h3-10H,2,11-14,20H2,1H3,(H,21,22);1H
InChIKeyCOVKYCSBYVABMW-UHFFFAOYSA-N
XLogP3.08
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.87
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-[[2-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-N-(2-phenylethyl)benzamide
CID 17123040
4-[[[2-(2-ethoxyethoxy)benzoyl]amino]methyl]benzoic acid
CID 119165428
N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyphenoxy)acetamide
CID 119548058
N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride
CID 119620824
N-[2-(4-aminophenyl)ethyl]-2-fluorobenzamide
CID 39359576
N-(4-amino-2-methoxyphenyl)-2-(2-ethoxyethoxy)benzamide
CID 54852699
2-(2-ethoxyethoxy)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 119513373
N-[2-(4-aminophenyl)ethyl]-3-(2-methoxyphenoxy)propanamide;hydrochloride
CID 119548049
2-amino-N-[2-(3,4-diethoxyphenyl)ethyl]benzamide
CID 119943708
2-propoxy-N-propylbenzamide
CID 58831728
N-[2-(4-aminophenyl)ethyl]-3-ethoxy-4-propoxybenzamide;hydrochloride
CID 119548952
2-(2-ethoxyethoxy)-N-(2-fluorophenyl)benzamide
CID 17122747

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride?
The IUPAC name of N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride (CID 119549073) is N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride.
What is the SMILES notation for N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride?
The canonical SMILES for N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride is CCOCCOc1ccccc1C(=O)NCCc1ccc(N)cc1.Cl.
What is the InChIKey of N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride?
The InChIKey is COVKYCSBYVABMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3.ClH/c1-2-23-13-14-24-18-6-4-3-5-17(18)19(22)21-12-11-15-7-9-16(20)10-8-15;/h3-10H,2,11-14,20H2,1H3,(H,21,22);1H.
What are the key properties of N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride?
N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride has a molecular weight of 364.87 g/mol, XLogP of 3.08, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride is sourced from PubChem (CID 119549073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).