N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide

C12H27N3O3 — CID 165098180

IUPACN,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide
SMILESCC(=O)N(C)C.CCC(=O)N(C)C.CNC(C)=O
InChIInChI=1S/C5H11NO.C4H9NO.C3H7NO/c1-4-5(7)6(2)3;1-4(6)5(2)3;1-3(5)4-2/h4H2,1-3H3;1-3H3;1-2H3,(H,4,5)
InChIKeyXWFDPARGZTZANU-UHFFFAOYSA-N
MW261.37 g/mol
LogP0.33
Rot. Bonds1

About N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide

N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide (PubChem CID 165098180) has the molecular formula C12H27N3O3 and a molecular weight of 261.37 g/mol. Its IUPAC name is N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide.

Molecular Properties

Compound NameN,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide
PubChem CID165098180
Molecular FormulaC12H27N3O3
Molecular Weight261.37 g/mol
Exact Mass261.21
IUPAC NameN,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide
SMILESCC(=O)N(C)C.CCC(=O)N(C)C.CNC(C)=O
InChIInChI=1S/C5H11NO.C4H9NO.C3H7NO/c1-4-5(7)6(2)3;1-4(6)5(2)3;1-3(5)4-2/h4H2,1-3H3;1-3H3;1-2H3,(H,4,5)
InChIKeyXWFDPARGZTZANU-UHFFFAOYSA-N
XLogP0.33
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethylacetamide;N,N-dimethylmethanamine;ethane;methane;N-methylacetamide;methyl acetate;propane;bis(propan-2-one)
CID 159346586
N,N-diethylethanamine;N-methylacetamide
CID 19745535
N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide
CID 157213260
N-acetyl-N-methylpropanamide;ethane
CID 143328121
sodium;N,N-dimethylpropanamide;triacetyloxyboranuide
CID 175843123
bis(N-methylacetamide);propan-2-one
CID 158104043
methane;N-methylacetamide
CID 169425645
azane;N,N-dimethylacetamide
CID 161145572
CID 159040973
CID 159040973
N,N-dimethylacetamide;oxalonitrile
CID 174761763
N,N-dimethylacetamide;ethane-1,2-diol
CID 19046924
ethane;methane;N-methylacetamide;propane;tetrakis(propan-2-one);hydroiodide
CID 158401112

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide?
The IUPAC name of N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide (CID 165098180) is N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide.
What is the SMILES notation for N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide?
The canonical SMILES for N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide is CC(=O)N(C)C.CCC(=O)N(C)C.CNC(C)=O.
What is the InChIKey of N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide?
The InChIKey is XWFDPARGZTZANU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO.C4H9NO.C3H7NO/c1-4-5(7)6(2)3;1-4(6)5(2)3;1-3(5)4-2/h4H2,1-3H3;1-3H3;1-2H3,(H,4,5).
What are the key properties of N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide?
N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide has a molecular weight of 261.37 g/mol, XLogP of 0.33, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide is sourced from PubChem (CID 165098180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).