2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide

C15H28N2O3 — CID 71392094

IUPAC2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide
SMILESCCC(CC)C(=O)NCC(=O)CNC(=O)C(CC)CC
InChIInChI=1S/C15H28N2O3/c1-5-11(6-2)14(19)16-9-13(18)10-17-15(20)12(7-3)8-4/h11-12H,5-10H2,1-4H3,(H,16,19)(H,17,20)
InChIKeyABPZOOYPEKYCLL-UHFFFAOYSA-N
MW284.40 g/mol
LogP1.66
Rot. Bonds10

About 2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide

2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide (PubChem CID 71392094) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide
PubChem CID71392094
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide
SMILESCCC(CC)C(=O)NCC(=O)CNC(=O)C(CC)CC
InChIInChI=1S/C15H28N2O3/c1-5-11(6-2)14(19)16-9-13(18)10-17-15(20)12(7-3)8-4/h11-12H,5-10H2,1-4H3,(H,16,19)(H,17,20)
InChIKeyABPZOOYPEKYCLL-UHFFFAOYSA-N
XLogP1.66
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[2-(dimethylamino)ethylamino]-2-oxoethyl]-2-ethylbutanamide
CID 112991411
2-ethyl-N-[(2R)-2-hydroxypropyl]butanamide
CID 39236453
2-ethylbutanoic acid;2-ethyl-N-[(2-ethylbutanoylamino)methyl]butanamide
CID 157432754
N-(2-aminopropyl)-2-ethylbutanamide
CID 63732725
2-ethyl-N-(2-oxo-2-piperazin-1-ylethyl)butanamide
CID 28708756
2,4-diethyl-N,N'-bis(2-hydroxyethyl)pentanediamide
CID 89382357
N-[2-(4-chlorophenyl)-2-oxoethyl]-2-ethylbutanamide
CID 94278694
N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide
CID 112997279
4-(2-ethylbutanoylamino)-2-hydroxybutanoic acid
CID 107832641
N-[2-(diethylcarbamoylamino)ethyl]-2-ethylbutanamide
CID 108573873
N-[2-(diethylamino)propyl]-2-ethylbutanamide
CID 78883396
2-ethyl-N-[2-oxo-2-(1-phenylethylamino)ethyl]butanamide
CID 112992317

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide?
The IUPAC name of 2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide (CID 71392094) is 2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide?
The canonical SMILES for 2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide is CCC(CC)C(=O)NCC(=O)CNC(=O)C(CC)CC.
What is the InChIKey of 2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide?
The InChIKey is ABPZOOYPEKYCLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-5-11(6-2)14(19)16-9-13(18)10-17-15(20)12(7-3)8-4/h11-12H,5-10H2,1-4H3,(H,16,19)(H,17,20).
What are the key properties of 2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide?
2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide has a molecular weight of 284.40 g/mol, XLogP of 1.66, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[3-(2-ethylbutanoylamino)-2-oxopropyl]butanamide is sourced from PubChem (CID 71392094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).