4-[2-(dipropylamino)-2-oxoethoxy]benzamide

C15H22N2O3 — CID 8566203

IUPAC4-[2-(dipropylamino)-2-oxoethoxy]benzamide
SMILESCCCN(CCC)C(=O)COc1ccc(C(N)=O)cc1
InChIInChI=1S/C15H22N2O3/c1-3-9-17(10-4-2)14(18)11-20-13-7-5-12(6-8-13)15(16)19/h5-8H,3-4,9-11H2,1-2H3,(H2,16,19)
InChIKeyQLPCEYNEPNFFFC-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.81
Rot. Bonds8

About 4-[2-(dipropylamino)-2-oxoethoxy]benzamide

4-[2-(dipropylamino)-2-oxoethoxy]benzamide (PubChem CID 8566203) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 4-[2-(dipropylamino)-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name4-[2-(dipropylamino)-2-oxoethoxy]benzamide
PubChem CID8566203
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name4-[2-(dipropylamino)-2-oxoethoxy]benzamide
SMILESCCCN(CCC)C(=O)COc1ccc(C(N)=O)cc1
InChIInChI=1S/C15H22N2O3/c1-3-9-17(10-4-2)14(18)11-20-13-7-5-12(6-8-13)15(16)19/h5-8H,3-4,9-11H2,1-2H3,(H2,16,19)
InChIKeyQLPCEYNEPNFFFC-UHFFFAOYSA-N
XLogP1.81
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(dipropylamino)-2-oxoethoxy]benzamide?
The IUPAC name of 4-[2-(dipropylamino)-2-oxoethoxy]benzamide (CID 8566203) is 4-[2-(dipropylamino)-2-oxoethoxy]benzamide.
What is the SMILES notation for 4-[2-(dipropylamino)-2-oxoethoxy]benzamide?
The canonical SMILES for 4-[2-(dipropylamino)-2-oxoethoxy]benzamide is CCCN(CCC)C(=O)COc1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[2-(dipropylamino)-2-oxoethoxy]benzamide?
The InChIKey is QLPCEYNEPNFFFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-3-9-17(10-4-2)14(18)11-20-13-7-5-12(6-8-13)15(16)19/h5-8H,3-4,9-11H2,1-2H3,(H2,16,19).
What are the key properties of 4-[2-(dipropylamino)-2-oxoethoxy]benzamide?
4-[2-(dipropylamino)-2-oxoethoxy]benzamide has a molecular weight of 278.35 g/mol, XLogP of 1.81, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(dipropylamino)-2-oxoethoxy]benzamide is sourced from PubChem (CID 8566203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).