acetamide;decanamide;dihydrochloride

C12H28Cl2N2O2 — CID 141131942

IUPACacetamide;decanamide;dihydrochloride
SMILESCC(N)=O.CCCCCCCCCC(N)=O.Cl.Cl
InChIInChI=1S/C10H21NO.C2H5NO.2ClH/c1-2-3-4-5-6-7-8-9-10(11)12;1-2(3)4;;/h2-9H2,1H3,(H2,11,12);1H3,(H2,3,4);2*1H
InChIKeyGDIFCRZIFIZKQV-UHFFFAOYSA-N
MW303.27 g/mol
LogP2.95
Rot. Bonds8

About acetamide;decanamide;dihydrochloride

acetamide;decanamide;dihydrochloride (PubChem CID 141131942) has the molecular formula C12H28Cl2N2O2 and a molecular weight of 303.27 g/mol. Its IUPAC name is acetamide;decanamide;dihydrochloride.

Molecular Properties

Compound Nameacetamide;decanamide;dihydrochloride
PubChem CID141131942
Molecular FormulaC12H28Cl2N2O2
Molecular Weight303.27 g/mol
Exact Mass302.15
IUPAC Nameacetamide;decanamide;dihydrochloride
SMILESCC(N)=O.CCCCCCCCCC(N)=O.Cl.Cl
InChIInChI=1S/C10H21NO.C2H5NO.2ClH/c1-2-3-4-5-6-7-8-9-10(11)12;1-2(3)4;;/h2-9H2,1H3,(H2,11,12);1H3,(H2,3,4);2*1H
InChIKeyGDIFCRZIFIZKQV-UHFFFAOYSA-N
XLogP2.95
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.27
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of acetamide;decanamide;dihydrochloride?
The IUPAC name of acetamide;decanamide;dihydrochloride (CID 141131942) is acetamide;decanamide;dihydrochloride.
What is the SMILES notation for acetamide;decanamide;dihydrochloride?
The canonical SMILES for acetamide;decanamide;dihydrochloride is CC(N)=O.CCCCCCCCCC(N)=O.Cl.Cl.
What is the InChIKey of acetamide;decanamide;dihydrochloride?
The InChIKey is GDIFCRZIFIZKQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO.C2H5NO.2ClH/c1-2-3-4-5-6-7-8-9-10(11)12;1-2(3)4;;/h2-9H2,1H3,(H2,11,12);1H3,(H2,3,4);2*1H.
What are the key properties of acetamide;decanamide;dihydrochloride?
acetamide;decanamide;dihydrochloride has a molecular weight of 303.27 g/mol, XLogP of 2.95, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for acetamide;decanamide;dihydrochloride is sourced from PubChem (CID 141131942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).