2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride

C15H25ClN2O3 — CID 119742175

IUPAC2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride
SMILESCOCCNCC(=O)NCCCc1ccc(OC)cc1.Cl
InChIInChI=1S/C15H24N2O3.ClH/c1-19-11-10-16-12-15(18)17-9-3-4-13-5-7-14(20-2)8-6-13;/h5-8,16H,3-4,9-12H2,1-2H3,(H,17,18);1H
InChIKeyBBTBUJHWMHIGFF-UHFFFAOYSA-N
MW316.83 g/mol
LogP1.40
Rot. Bonds10

About 2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride

2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride (PubChem CID 119742175) has the molecular formula C15H25ClN2O3 and a molecular weight of 316.83 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride
PubChem CID119742175
Molecular FormulaC15H25ClN2O3
Molecular Weight316.83 g/mol
Exact Mass316.16
IUPAC Name2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride
SMILESCOCCNCC(=O)NCCCc1ccc(OC)cc1.Cl
InChIInChI=1S/C15H24N2O3.ClH/c1-19-11-10-16-12-15(18)17-9-3-4-13-5-7-14(20-2)8-6-13;/h5-8,16H,3-4,9-12H2,1-2H3,(H,17,18);1H
InChIKeyBBTBUJHWMHIGFF-UHFFFAOYSA-N
XLogP1.40
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.83
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(4-methoxyphenyl)ethylamino]-N-propylacetamide
CID 28574182
2-amino-N-[3-(4-methoxyphenyl)propyl]acetamide
CID 119299625
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethylamino)acetamide
CID 78912541
2-(2-methoxyethylamino)-N-(3-methoxypropyl)acetamide;hydrochloride
CID 119672351
N-[2-(4-fluorophenyl)ethyl]-2-[2-(4-methoxyphenoxy)ethylamino]acetamide
CID 109000540
N-[3-(4-methoxyphenyl)propyl]-2-(4-phenylphenyl)acetamide
CID 100516355
2-(2-methoxyethylamino)-N-(4-methoxyphenyl)acetamide
CID 28565585
2-(2-methoxyethylamino)-N-[[4-(2-methoxyphenoxy)phenyl]methyl]acetamide;hydrochloride
CID 119780941
N-[3-(4-methoxyphenyl)propyl]-3-[(2-phenylacetyl)amino]propanamide
CID 55919627
3-(2-methoxyethylamino)-N-(3-phenylpropyl)propanamide
CID 109015207
N-[3-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)acetamide
CID 93165804
3-(4-methoxyphenyl)-N-[8-[3-(4-methoxyphenyl)propanoylamino]octyl]propanamide
CID 4661025

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride?
The IUPAC name of 2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride (CID 119742175) is 2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride?
The canonical SMILES for 2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride is COCCNCC(=O)NCCCc1ccc(OC)cc1.Cl.
What is the InChIKey of 2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride?
The InChIKey is BBTBUJHWMHIGFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3.ClH/c1-19-11-10-16-12-15(18)17-9-3-4-13-5-7-14(20-2)8-6-13;/h5-8,16H,3-4,9-12H2,1-2H3,(H,17,18);1H.
What are the key properties of 2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride?
2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride has a molecular weight of 316.83 g/mol, XLogP of 1.40, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-[3-(4-methoxyphenyl)propyl]acetamide;hydrochloride is sourced from PubChem (CID 119742175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).