acetamide;acetic acid;ethanamine;propane

C11H28N2O5 — CID 160501368

IUPACacetamide;acetic acid;ethanamine;propane
SMILESCC(=O)O.CC(=O)O.CC(N)=O.CCC.CCN
InChIInChI=1S/C3H8.C2H5NO.C2H7N.2C2H4O2/c1-3-2;1-2(3)4;1-2-3;2*1-2(3)4/h3H2,1-2H3;1H3,(H2,3,4);2-3H2,1H3;2*1H3,(H,3,4)
InChIKeyXXWOHUSGKJATKK-UHFFFAOYSA-N
MW268.35 g/mol
LogP1.05
Rot. Bonds

About acetamide;acetic acid;ethanamine;propane

acetamide;acetic acid;ethanamine;propane (PubChem CID 160501368) has the molecular formula C11H28N2O5 and a molecular weight of 268.35 g/mol. Its IUPAC name is acetamide;acetic acid;ethanamine;propane.

Molecular Properties

Compound Nameacetamide;acetic acid;ethanamine;propane
PubChem CID160501368
Molecular FormulaC11H28N2O5
Molecular Weight268.35 g/mol
Exact Mass268.20
IUPAC Nameacetamide;acetic acid;ethanamine;propane
SMILESCC(=O)O.CC(=O)O.CC(N)=O.CCC.CCN
InChIInChI=1S/C3H8.C2H5NO.C2H7N.2C2H4O2/c1-3-2;1-2(3)4;1-2-3;2*1-2(3)4/h3H2,1-2H3;1H3,(H2,3,4);2-3H2,1H3;2*1H3,(H,3,4)
InChIKeyXXWOHUSGKJATKK-UHFFFAOYSA-N
XLogP1.05
TPSA143.71 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.35
LogP ≤ 51.05
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of acetamide;acetic acid;ethanamine;propane?
The IUPAC name of acetamide;acetic acid;ethanamine;propane (CID 160501368) is acetamide;acetic acid;ethanamine;propane.
What is the SMILES notation for acetamide;acetic acid;ethanamine;propane?
The canonical SMILES for acetamide;acetic acid;ethanamine;propane is CC(=O)O.CC(=O)O.CC(N)=O.CCC.CCN.
What is the InChIKey of acetamide;acetic acid;ethanamine;propane?
The InChIKey is XXWOHUSGKJATKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8.C2H5NO.C2H7N.2C2H4O2/c1-3-2;1-2(3)4;1-2-3;2*1-2(3)4/h3H2,1-2H3;1H3,(H2,3,4);2-3H2,1H3;2*1H3,(H,3,4).
What are the key properties of acetamide;acetic acid;ethanamine;propane?
acetamide;acetic acid;ethanamine;propane has a molecular weight of 268.35 g/mol, XLogP of 1.05, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for acetamide;acetic acid;ethanamine;propane is sourced from PubChem (CID 160501368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).