N,N-diethylacetamide;N,N-dimethylformamide

C9H20N2O2 — CID 22598639

IUPACN,N-diethylacetamide;N,N-dimethylformamide
SMILESCCN(CC)C(C)=O.CN(C)C=O
InChIInChI=1S/C6H13NO.C3H7NO/c1-4-7(5-2)6(3)8;1-4(2)3-5/h4-5H2,1-3H3;3H,1-2H3
InChIKeyCTLSWQCNBBIODE-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.58
Rot. Bonds3

About N,N-diethylacetamide;N,N-dimethylformamide

N,N-diethylacetamide;N,N-dimethylformamide (PubChem CID 22598639) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N,N-diethylacetamide;N,N-dimethylformamide.

Molecular Properties

Compound NameN,N-diethylacetamide;N,N-dimethylformamide
PubChem CID22598639
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC NameN,N-diethylacetamide;N,N-dimethylformamide
SMILESCCN(CC)C(C)=O.CN(C)C=O
InChIInChI=1S/C6H13NO.C3H7NO/c1-4-7(5-2)6(3)8;1-4(2)3-5/h4-5H2,1-3H3;3H,1-2H3
InChIKeyCTLSWQCNBBIODE-UHFFFAOYSA-N
XLogP0.58
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-diethylacetamide;N,N-dimethylformamide?
The IUPAC name of N,N-diethylacetamide;N,N-dimethylformamide (CID 22598639) is N,N-diethylacetamide;N,N-dimethylformamide.
What is the SMILES notation for N,N-diethylacetamide;N,N-dimethylformamide?
The canonical SMILES for N,N-diethylacetamide;N,N-dimethylformamide is CCN(CC)C(C)=O.CN(C)C=O.
What is the InChIKey of N,N-diethylacetamide;N,N-dimethylformamide?
The InChIKey is CTLSWQCNBBIODE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.C3H7NO/c1-4-7(5-2)6(3)8;1-4(2)3-5/h4-5H2,1-3H3;3H,1-2H3.
What are the key properties of N,N-diethylacetamide;N,N-dimethylformamide?
N,N-diethylacetamide;N,N-dimethylformamide has a molecular weight of 188.27 g/mol, XLogP of 0.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylacetamide;N,N-dimethylformamide is sourced from PubChem (CID 22598639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).