2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride

C9H23Cl2N3O2 — CID 119855427

IUPAC2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride
SMILESCOCCN(C)CCCNC(=O)CN.Cl.Cl
InChIInChI=1S/C9H21N3O2.2ClH/c1-12(6-7-14-2)5-3-4-11-9(13)8-10;;/h3-8,10H2,1-2H3,(H,11,13);2*1H
InChIKeyJPYBJSFHDMABTK-UHFFFAOYSA-N
MW276.21 g/mol
LogP-0.13
Rot. Bonds8

About 2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride

2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride (PubChem CID 119855427) has the molecular formula C9H23Cl2N3O2 and a molecular weight of 276.21 g/mol. Its IUPAC name is 2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride
PubChem CID119855427
Molecular FormulaC9H23Cl2N3O2
Molecular Weight276.21 g/mol
Exact Mass275.12
IUPAC Name2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride
SMILESCOCCN(C)CCCNC(=O)CN.Cl.Cl
InChIInChI=1S/C9H21N3O2.2ClH/c1-12(6-7-14-2)5-3-4-11-9(13)8-10;;/h3-8,10H2,1-2H3,(H,11,13);2*1H
InChIKeyJPYBJSFHDMABTK-UHFFFAOYSA-N
XLogP-0.13
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.21
LogP ≤ 5-0.13
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-(4-aminophenyl)-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride
CID 119855399
N-[3-[2-methoxyethyl(methyl)amino]propyl]-2-methyl-3-(methylamino)propanamide
CID 119855422
2-amino-N-[3-[benzyl(methyl)amino]propyl]acetamide;dihydrochloride
CID 119835671
2-amino-N-[2-[3-(2-methoxyethoxy)propylamino]-2-oxoethyl]acetamide
CID 61274452
2-amino-N-[2-[[2-(3-methoxypropylamino)-2-oxoethyl]-methylamino]-2-oxoethyl]acetamide
CID 54874049
N-[3-[3-aminopropyl(methyl)amino]propyl]propanamide
CID 59112854
2-amino-N-[2-(dimethylamino)ethyl]acetamide;dihydrochloride
CID 56832115
N-[3-(dimethylamino)propyl]-2-(2-methoxyethylamino)acetamide;dihydrochloride
CID 119827417
N-[3-[2-methoxyethyl(methyl)amino]propyl]-2-thiomorpholin-3-ylacetamide
CID 119941360
3-amino-N-(3-methoxypropyl)propanamide;hydrochloride
CID 56832126
2-amino-N-[3-(dipropylamino)propyl]acetamide
CID 119861226
4-[2-[2-methoxyethyl(methyl)amino]ethylcarbamoylamino]butanoic acid
CID 55126918

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride?
The IUPAC name of 2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride (CID 119855427) is 2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride.
What is the SMILES notation for 2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride?
The canonical SMILES for 2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride is COCCN(C)CCCNC(=O)CN.Cl.Cl.
What is the InChIKey of 2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride?
The InChIKey is JPYBJSFHDMABTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2.2ClH/c1-12(6-7-14-2)5-3-4-11-9(13)8-10;;/h3-8,10H2,1-2H3,(H,11,13);2*1H.
What are the key properties of 2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride?
2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride has a molecular weight of 276.21 g/mol, XLogP of -0.13, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-[2-methoxyethyl(methyl)amino]propyl]acetamide;dihydrochloride is sourced from PubChem (CID 119855427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).