N-(2,2-diethoxyethyl)butanamide

C10H21NO3 — CID 79548415

IUPACN-(2,2-diethoxyethyl)butanamide
SMILESCCCC(=O)NCC(OCC)OCC
InChIInChI=1S/C10H21NO3/c1-4-7-9(12)11-8-10(13-5-2)14-6-3/h10H,4-8H2,1-3H3,(H,11,12)
InChIKeyUUNZUCVGORXWPG-UHFFFAOYSA-N
MW203.28 g/mol
LogP1.30
Rot. Bonds8

About N-(2,2-diethoxyethyl)butanamide

N-(2,2-diethoxyethyl)butanamide (PubChem CID 79548415) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is N-(2,2-diethoxyethyl)butanamide.

Molecular Properties

Compound NameN-(2,2-diethoxyethyl)butanamide
PubChem CID79548415
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC NameN-(2,2-diethoxyethyl)butanamide
SMILESCCCC(=O)NCC(OCC)OCC
InChIInChI=1S/C10H21NO3/c1-4-7-9(12)11-8-10(13-5-2)14-6-3/h10H,4-8H2,1-3H3,(H,11,12)
InChIKeyUUNZUCVGORXWPG-UHFFFAOYSA-N
XLogP1.30
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis(2,2-diethoxyethyl)pentanediamide
CID 141334867
N-(2,2-diethoxyethyl)hexanamide
CID 79547284
N-(2,2-diethoxyethyl)-3-(ethylamino)propanamide
CID 79547706
5-amino-N-(2,2-diethoxyethyl)pentanamide
CID 79547358
2-chloro-N-(2,2-diethoxyethyl)acetamide
CID 12663166
6-amino-N-(2,2-diethoxyethyl)-4-methylhexanamide
CID 79547447
(2,3,4,5,6-pentafluorophenyl) 5-(2,2-diethoxyethylamino)-5-oxopentanoate
CID 14938940
3-(4-aminophenyl)-N-(2,2-diethoxyethyl)propanamide
CID 115341571
5-(2,2-diethoxyethylamino)-3-methyl-5-oxopentanoic acid
CID 79548215
4-amino-N-(2,2-diethoxyethyl)-3-methylbutanamide
CID 81079644
N-(2-chloropropyl)butanamide
CID 57294659
N-(2,2-diethoxyethyl)-2-methylpentanamide
CID 79547187

Frequently Asked Questions

What is the IUPAC name of N-(2,2-diethoxyethyl)butanamide?
The IUPAC name of N-(2,2-diethoxyethyl)butanamide (CID 79548415) is N-(2,2-diethoxyethyl)butanamide.
What is the SMILES notation for N-(2,2-diethoxyethyl)butanamide?
The canonical SMILES for N-(2,2-diethoxyethyl)butanamide is CCCC(=O)NCC(OCC)OCC.
What is the InChIKey of N-(2,2-diethoxyethyl)butanamide?
The InChIKey is UUNZUCVGORXWPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-4-7-9(12)11-8-10(13-5-2)14-6-3/h10H,4-8H2,1-3H3,(H,11,12).
What are the key properties of N-(2,2-diethoxyethyl)butanamide?
N-(2,2-diethoxyethyl)butanamide has a molecular weight of 203.28 g/mol, XLogP of 1.30, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-diethoxyethyl)butanamide is sourced from PubChem (CID 79548415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).