2-propoxy-N,N-dipropylacetamide

C11H23NO2 — CID 48656359

IUPAC2-propoxy-N,N-dipropylacetamide
SMILESCCCOCC(=O)N(CCC)CCC
InChIInChI=1S/C11H23NO2/c1-4-7-12(8-5-2)11(13)10-14-9-6-3/h4-10H2,1-3H3
InChIKeyWGZBNTDXFNPQNC-UHFFFAOYSA-N
MW201.31 g/mol
LogP2.06
Rot. Bonds8

About 2-propoxy-N,N-dipropylacetamide

2-propoxy-N,N-dipropylacetamide (PubChem CID 48656359) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-propoxy-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-propoxy-N,N-dipropylacetamide
PubChem CID48656359
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name2-propoxy-N,N-dipropylacetamide
SMILESCCCOCC(=O)N(CCC)CCC
InChIInChI=1S/C11H23NO2/c1-4-7-12(8-5-2)11(13)10-14-9-6-3/h4-10H2,1-3H3
InChIKeyWGZBNTDXFNPQNC-UHFFFAOYSA-N
XLogP2.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-propoxy-N,N-dipropylacetamide?
The IUPAC name of 2-propoxy-N,N-dipropylacetamide (CID 48656359) is 2-propoxy-N,N-dipropylacetamide.
What is the SMILES notation for 2-propoxy-N,N-dipropylacetamide?
The canonical SMILES for 2-propoxy-N,N-dipropylacetamide is CCCOCC(=O)N(CCC)CCC.
What is the InChIKey of 2-propoxy-N,N-dipropylacetamide?
The InChIKey is WGZBNTDXFNPQNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-4-7-12(8-5-2)11(13)10-14-9-6-3/h4-10H2,1-3H3.
What are the key properties of 2-propoxy-N,N-dipropylacetamide?
2-propoxy-N,N-dipropylacetamide has a molecular weight of 201.31 g/mol, XLogP of 2.06, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propoxy-N,N-dipropylacetamide is sourced from PubChem (CID 48656359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).