N,N-dimethylacetamide;N-methylformamide

C6H14N2O2 — CID 159272937

IUPACN,N-dimethylacetamide;N-methylformamide
SMILESCC(=O)N(C)C.CNC=O
InChIInChI=1S/C4H9NO.C2H5NO/c1-4(6)5(2)3;1-3-2-4/h1-3H3;2H,1H3,(H,3,4)
InChIKeyKXYAWDCKXPPIDM-UHFFFAOYSA-N
MW146.19 g/mol
LogP-0.54
Rot. Bonds1

About N,N-dimethylacetamide;N-methylformamide

N,N-dimethylacetamide;N-methylformamide (PubChem CID 159272937) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is N,N-dimethylacetamide;N-methylformamide.

Molecular Properties

Compound NameN,N-dimethylacetamide;N-methylformamide
PubChem CID159272937
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC NameN,N-dimethylacetamide;N-methylformamide
SMILESCC(=O)N(C)C.CNC=O
InChIInChI=1S/C4H9NO.C2H5NO/c1-4(6)5(2)3;1-3-2-4/h1-3H3;2H,1H3,(H,3,4)
InChIKeyKXYAWDCKXPPIDM-UHFFFAOYSA-N
XLogP-0.54
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 5-0.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N'-[Oxybis(methylene)]diacetamide
CID 15921484
CID 19758971
CID 19758971
N,N-dimethylacetamide;N-methylacetamide
CID 21328725
N-methylacetamide;N-methylformamide
CID 21715506
N,N-dimethylformamide;N-methylacetamide
CID 22057705
acetamide;N-methylacetamide
CID 22906249
acetamide;N,N-dimethylformamide
CID 55290862
N-methylacetamide;N,2,2,2-tetradeuterio-N-(trideuteriomethyl)acetamide
CID 87229203
formamide;N-methylacetamide
CID 87879452
N,N-dimethylacetamide;formamide
CID 88505567
acetamide;N-methylformamide
CID 88762249
N-(formamidomethyl)-N-methylacetamide
CID 126577407

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylacetamide;N-methylformamide?
The IUPAC name of N,N-dimethylacetamide;N-methylformamide (CID 159272937) is N,N-dimethylacetamide;N-methylformamide.
What is the SMILES notation for N,N-dimethylacetamide;N-methylformamide?
The canonical SMILES for N,N-dimethylacetamide;N-methylformamide is CC(=O)N(C)C.CNC=O.
What is the InChIKey of N,N-dimethylacetamide;N-methylformamide?
The InChIKey is KXYAWDCKXPPIDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.C2H5NO/c1-4(6)5(2)3;1-3-2-4/h1-3H3;2H,1H3,(H,3,4).
What are the key properties of N,N-dimethylacetamide;N-methylformamide?
N,N-dimethylacetamide;N-methylformamide has a molecular weight of 146.19 g/mol, XLogP of -0.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylacetamide;N-methylformamide is sourced from PubChem (CID 159272937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).