2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride

C20H26ClN3O3 — CID 119676959

IUPAC2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride
SMILESCOCCNCC(=O)Nc1ccccc1C(=O)NCCc1ccccc1.Cl
InChIInChI=1S/C20H25N3O3.ClH/c1-26-14-13-21-15-19(24)23-18-10-6-5-9-17(18)20(25)22-12-11-16-7-3-2-4-8-16;/h2-10,21H,11-15H2,1H3,(H,22,25)(H,23,24);1H
InChIKeyGANXYABJSMQTMW-UHFFFAOYSA-N
MW391.90 g/mol
LogP2.26
Rot. Bonds10

About 2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride

2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride (PubChem CID 119676959) has the molecular formula C20H26ClN3O3 and a molecular weight of 391.90 g/mol. Its IUPAC name is 2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride.

Molecular Properties

Compound Name2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride
PubChem CID119676959
Molecular FormulaC20H26ClN3O3
Molecular Weight391.90 g/mol
Exact Mass391.17
IUPAC Name2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride
SMILESCOCCNCC(=O)Nc1ccccc1C(=O)NCCc1ccccc1.Cl
InChIInChI=1S/C20H25N3O3.ClH/c1-26-14-13-21-15-19(24)23-18-10-6-5-9-17(18)20(25)22-12-11-16-7-3-2-4-8-16;/h2-10,21H,11-15H2,1H3,(H,22,25)(H,23,24);1H
InChIKeyGANXYABJSMQTMW-UHFFFAOYSA-N
XLogP2.26
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.90
LogP ≤ 52.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide;hydrochloride
CID 119679544
N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide
CID 119679545
N-(2-methoxyethyl)-2-(3-phenylpropanoylamino)benzamide
CID 2206654
2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-methylpropyl)benzamide;hydrochloride
CID 119684657
2-[[2-[(2-phenylacetyl)amino]acetyl]amino]-N-(2-phenylethyl)benzamide
CID 33252278
N,N-diethyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide;hydrochloride
CID 119746610
ethyl 2-[[2-(2-phenylethylamino)acetyl]amino]benzoate
CID 108999964
ethyl 2-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]sulfanylacetate
CID 8594862
methyl 4-[[2-(2-phenylethylcarbamoyl)phenyl]carbamoyl]benzoate
CID 17178238
[2-(2-phenylethylcarbamoyl)phenyl]carbamothioic S-acid
CID 155166285
[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl] 4-methylbenzoate
CID 9018254
2-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide
CID 2193182

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride?
The IUPAC name of 2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride (CID 119676959) is 2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride.
What is the SMILES notation for 2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride?
The canonical SMILES for 2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride is COCCNCC(=O)Nc1ccccc1C(=O)NCCc1ccccc1.Cl.
What is the InChIKey of 2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride?
The InChIKey is GANXYABJSMQTMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3.ClH/c1-26-14-13-21-15-19(24)23-18-10-6-5-9-17(18)20(25)22-12-11-16-7-3-2-4-8-16;/h2-10,21H,11-15H2,1H3,(H,22,25)(H,23,24);1H.
What are the key properties of 2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride?
2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride has a molecular weight of 391.90 g/mol, XLogP of 2.26, 10 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride is sourced from PubChem (CID 119676959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).