N,N-dimethyl-2-oxopropanamide;ethane

C7H15NO2 — CID 176960405

IUPACN,N-dimethyl-2-oxopropanamide;ethane
SMILESCC.CC(=O)C(=O)N(C)C
InChIInChI=1S/C5H9NO2.C2H6/c1-4(7)5(8)6(2)3;1-2/h1-3H3;1-2H3
InChIKeyHZSFJEINQIUEFJ-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.69
Rot. Bonds1

About N,N-dimethyl-2-oxopropanamide;ethane

N,N-dimethyl-2-oxopropanamide;ethane (PubChem CID 176960405) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is N,N-dimethyl-2-oxopropanamide;ethane.

Molecular Properties

Compound NameN,N-dimethyl-2-oxopropanamide;ethane
PubChem CID176960405
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC NameN,N-dimethyl-2-oxopropanamide;ethane
SMILESCC.CC(=O)C(=O)N(C)C
InChIInChI=1S/C5H9NO2.C2H6/c1-4(7)5(8)6(2)3;1-2/h1-3H3;1-2H3
InChIKeyHZSFJEINQIUEFJ-UHFFFAOYSA-N
XLogP0.69
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-oxopropanamide;ethane?
The IUPAC name of N,N-dimethyl-2-oxopropanamide;ethane (CID 176960405) is N,N-dimethyl-2-oxopropanamide;ethane.
What is the SMILES notation for N,N-dimethyl-2-oxopropanamide;ethane?
The canonical SMILES for N,N-dimethyl-2-oxopropanamide;ethane is CC.CC(=O)C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-oxopropanamide;ethane?
The InChIKey is HZSFJEINQIUEFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2.C2H6/c1-4(7)5(8)6(2)3;1-2/h1-3H3;1-2H3.
What are the key properties of N,N-dimethyl-2-oxopropanamide;ethane?
N,N-dimethyl-2-oxopropanamide;ethane has a molecular weight of 145.20 g/mol, XLogP of 0.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-oxopropanamide;ethane is sourced from PubChem (CID 176960405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).