N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride

C13H21ClN2O4 — CID 119674285

IUPACN-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride
SMILESCOCCNCC(=O)Nc1cc(OC)ccc1OC.Cl
InChIInChI=1S/C13H20N2O4.ClH/c1-17-7-6-14-9-13(16)15-11-8-10(18-2)4-5-12(11)19-3;/h4-5,8,14H,6-7,9H2,1-3H3,(H,15,16);1H
InChIKeyWCEPDHQFKZNXMU-UHFFFAOYSA-N
MW304.77 g/mol
LogP1.30
Rot. Bonds8

About N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride

N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride (PubChem CID 119674285) has the molecular formula C13H21ClN2O4 and a molecular weight of 304.77 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride
PubChem CID119674285
Molecular FormulaC13H21ClN2O4
Molecular Weight304.77 g/mol
Exact Mass304.12
IUPAC NameN-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride
SMILESCOCCNCC(=O)Nc1cc(OC)ccc1OC.Cl
InChIInChI=1S/C13H20N2O4.ClH/c1-17-7-6-14-9-13(16)15-11-8-10(18-2)4-5-12(11)19-3;/h4-5,8,14H,6-7,9H2,1-3H3,(H,15,16);1H
InChIKeyWCEPDHQFKZNXMU-UHFFFAOYSA-N
XLogP1.30
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.77
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-(2-methoxyethylamino)acetamide
CID 78908383
N-(2,5-dimethoxyphenyl)-2-[2-(dimethylamino)ethylamino]acetamide
CID 108994518
N-(2,5-dimethoxyphenyl)-2-(heptylamino)acetamide
CID 54814780
2-[2-(4-chlorophenyl)ethylamino]-N-(2,5-dimethoxyphenyl)acetamide
CID 109002869
N'-(2,5-dimethoxyphenyl)-N-(2-methoxy-5-methylphenyl)propanediamide
CID 108955778
2-(2-methoxyethylamino)-N-(2-methoxy-4-methylphenyl)acetamide
CID 79282634
N,N'-bis(2,5-dimethoxyphenyl)butanediamide
CID 1011774
2-(2-methoxyethylamino)-N-(4-methoxyphenyl)acetamide
CID 28565585
2-[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(2,5-dimethoxyphenyl)acetamide
CID 35495479
N-[1-(2,5-dimethoxyphenyl)ethyl]-2-(2-methoxyethylamino)acetamide
CID 78912543
N'-(2,5-dimethoxyphenyl)-N-propylpropanediamide
CID 108940714
N-(2-chloro-4,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide
CID 79281493

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride (CID 119674285) is N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride is COCCNCC(=O)Nc1cc(OC)ccc1OC.Cl.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride?
The InChIKey is WCEPDHQFKZNXMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O4.ClH/c1-17-7-6-14-9-13(16)15-11-8-10(18-2)4-5-12(11)19-3;/h4-5,8,14H,6-7,9H2,1-3H3,(H,15,16);1H.
What are the key properties of N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride?
N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride has a molecular weight of 304.77 g/mol, XLogP of 1.30, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride is sourced from PubChem (CID 119674285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).