bis(N-methylacetamide);propan-2-one

C9H20N2O3 — CID 158104043

IUPACbis(N-methylacetamide);propan-2-one
SMILESCC(C)=O.CNC(C)=O.CNC(C)=O
InChIInChI=1S/2C3H7NO.C3H6O/c2*1-3(5)4-2;1-3(2)4/h2*1-2H3,(H,4,5);1-2H3
InChIKeyFPPPUAVRASTBTQ-UHFFFAOYSA-N
MW204.27 g/mol
LogP0.10
Rot. Bonds

About bis(N-methylacetamide);propan-2-one

bis(N-methylacetamide);propan-2-one (PubChem CID 158104043) has the molecular formula C9H20N2O3 and a molecular weight of 204.27 g/mol. Its IUPAC name is bis(N-methylacetamide);propan-2-one.

Molecular Properties

Compound Namebis(N-methylacetamide);propan-2-one
PubChem CID158104043
Molecular FormulaC9H20N2O3
Molecular Weight204.27 g/mol
Exact Mass204.15
IUPAC Namebis(N-methylacetamide);propan-2-one
SMILESCC(C)=O.CNC(C)=O.CNC(C)=O
InChIInChI=1S/2C3H7NO.C3H6O/c2*1-3(5)4-2;1-3(2)4/h2*1-2H3,(H,4,5);1-2H3
InChIKeyFPPPUAVRASTBTQ-UHFFFAOYSA-N
XLogP0.10
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methanamine;bis(N-methylacetamide);propan-2-one
CID 157204854
methane;N-methylacetamide
CID 169425645
CID 159040973
CID 159040973
ethane;methane;N-methylacetamide
CID 159401147
potassium;hydride;N-methylacetamide
CID 173418413
formaldehyde;N-methylacetamide
CID 159490973
N-methylacetamide;pentane-2,4-dione;bis(propan-2-one)
CID 91069648
N-methylacetamide;propan-2-ylazanium
CID 158450921
methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium
CID 160843944
N-methylacetamide;phosphoric acid
CID 174660683
ethane;methane;N-methylacetamide;propane;tetrakis(propan-2-one);hydroiodide
CID 158401112
bis(N-methylacetamide);propan-2-amine;propan-2-ylazanium
CID 169429342

Frequently Asked Questions

What is the IUPAC name of bis(N-methylacetamide);propan-2-one?
The IUPAC name of bis(N-methylacetamide);propan-2-one (CID 158104043) is bis(N-methylacetamide);propan-2-one.
What is the SMILES notation for bis(N-methylacetamide);propan-2-one?
The canonical SMILES for bis(N-methylacetamide);propan-2-one is CC(C)=O.CNC(C)=O.CNC(C)=O.
What is the InChIKey of bis(N-methylacetamide);propan-2-one?
The InChIKey is FPPPUAVRASTBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7NO.C3H6O/c2*1-3(5)4-2;1-3(2)4/h2*1-2H3,(H,4,5);1-2H3.
What are the key properties of bis(N-methylacetamide);propan-2-one?
bis(N-methylacetamide);propan-2-one has a molecular weight of 204.27 g/mol, XLogP of 0.10, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N-methylacetamide);propan-2-one is sourced from PubChem (CID 158104043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).