2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide

C15H34N4O5 — CID 157380702

IUPAC2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide
SMILESC.CCNC(=O)CNC(C)=O.CNC(C)=O.COCCNC(C)=O
InChIInChI=1S/C6H12N2O2.C5H11NO2.C3H7NO.CH4/c1-3-7-6(10)4-8-5(2)9;1-5(7)6-3-4-8-2;1-3(5)4-2;/h3-4H2,1-2H3,(H,7,10)(H,8,9);3-4H2,1-2H3,(H,6,7);1-2H3,(H,4,5);1H4
InChIKeyBKVUETYSOKQDTN-UHFFFAOYSA-N
MW350.46 g/mol
LogP-0.58
Rot. Bonds6

About 2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide

2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide (PubChem CID 157380702) has the molecular formula C15H34N4O5 and a molecular weight of 350.46 g/mol. Its IUPAC name is 2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide.

Molecular Properties

Compound Name2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide
PubChem CID157380702
Molecular FormulaC15H34N4O5
Molecular Weight350.46 g/mol
Exact Mass350.25
IUPAC Name2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide
SMILESC.CCNC(=O)CNC(C)=O.CNC(C)=O.COCCNC(C)=O
InChIInChI=1S/C6H12N2O2.C5H11NO2.C3H7NO.CH4/c1-3-7-6(10)4-8-5(2)9;1-5(7)6-3-4-8-2;1-3(5)4-2;/h3-4H2,1-2H3,(H,7,10)(H,8,9);3-4H2,1-2H3,(H,6,7);1-2H3,(H,4,5);1H4
InChIKeyBKVUETYSOKQDTN-UHFFFAOYSA-N
XLogP-0.58
TPSA125.63 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 5-0.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide?
The IUPAC name of 2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide (CID 157380702) is 2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide.
What is the SMILES notation for 2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide?
The canonical SMILES for 2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide is C.CCNC(=O)CNC(C)=O.CNC(C)=O.COCCNC(C)=O.
What is the InChIKey of 2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide?
The InChIKey is BKVUETYSOKQDTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2.C5H11NO2.C3H7NO.CH4/c1-3-7-6(10)4-8-5(2)9;1-5(7)6-3-4-8-2;1-3(5)4-2;/h3-4H2,1-2H3,(H,7,10)(H,8,9);3-4H2,1-2H3,(H,6,7);1-2H3,(H,4,5);1H4.
What are the key properties of 2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide?
2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide has a molecular weight of 350.46 g/mol, XLogP of -0.58, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-ethylacetamide;methane;N-(2-methoxyethyl)acetamide;N-methylacetamide is sourced from PubChem (CID 157380702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).