2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide

C18H36N2O4 — CID 540251

IUPAC2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)COCCOCC(=O)N(CCC)CCC
InChIInChI=1S/C18H36N2O4/c1-5-9-19(10-6-2)17(21)15-23-13-14-24-16-18(22)20(11-7-3)12-8-4/h5-16H2,1-4H3
InChIKeyJKYQHRQZACALTC-UHFFFAOYSA-N
MW344.50 g/mol
LogP2.32
Rot. Bonds15

About 2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide

2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide (PubChem CID 540251) has the molecular formula C18H36N2O4 and a molecular weight of 344.50 g/mol. Its IUPAC name is 2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide
PubChem CID540251
Molecular FormulaC18H36N2O4
Molecular Weight344.50 g/mol
Exact Mass344.27
IUPAC Name2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)COCCOCC(=O)N(CCC)CCC
InChIInChI=1S/C18H36N2O4/c1-5-9-19(10-6-2)17(21)15-23-13-14-24-16-18(22)20(11-7-3)12-8-4/h5-16H2,1-4H3
InChIKeyJKYQHRQZACALTC-UHFFFAOYSA-N
XLogP2.32
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.50
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide?
The IUPAC name of 2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide (CID 540251) is 2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide?
The canonical SMILES for 2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide is CCCN(CCC)C(=O)COCCOCC(=O)N(CCC)CCC.
What is the InChIKey of 2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide?
The InChIKey is JKYQHRQZACALTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O4/c1-5-9-19(10-6-2)17(21)15-23-13-14-24-16-18(22)20(11-7-3)12-8-4/h5-16H2,1-4H3.
What are the key properties of 2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide?
2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide has a molecular weight of 344.50 g/mol, XLogP of 2.32, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(dipropylamino)-2-oxoethoxy]ethoxy]-N,N-dipropylacetamide is sourced from PubChem (CID 540251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).