N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide

C14H28N2O2 — CID 78790706

IUPACN-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide
SMILESCCN(CC(=O)NC(C)(C)C)C(=O)CCC(C)C
InChIInChI=1S/C14H28N2O2/c1-7-16(13(18)9-8-11(2)3)10-12(17)15-14(4,5)6/h11H,7-10H2,1-6H3,(H,15,17)
InChIKeyNYSMLCNJWMOYOI-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.19
Rot. Bonds6

About N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide

N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide (PubChem CID 78790706) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide.

Molecular Properties

Compound NameN-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide
PubChem CID78790706
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide
SMILESCCN(CC(=O)NC(C)(C)C)C(=O)CCC(C)C
InChIInChI=1S/C14H28N2O2/c1-7-16(13(18)9-8-11(2)3)10-12(17)15-14(4,5)6/h11H,7-10H2,1-6H3,(H,15,17)
InChIKeyNYSMLCNJWMOYOI-UHFFFAOYSA-N
XLogP2.19
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2-[(2-chloroacetyl)-ethylamino]acetamide
CID 2113270
ethyl 2-[ethyl(4-methylpentanoyl)amino]acetate
CID 61012376
N-tert-butyl-N',N'-diethylpropanediamide
CID 108951053
N-ethyl-4-methyl-N-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]pentanamide
CID 134059299
N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-2-(1-hydroxycyclohexyl)acetamide
CID 111331751
[2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-(4-methylpentanoylamino)acetate
CID 56519548
N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide
CID 43008615
N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-3-(4-methoxyphenyl)sulfanylpropanamide
CID 35363009
N-tert-butyl-2-(diethylamino)acetamide;hydrochloride
CID 138397018
N-[2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-2-oxoethyl]-2-chlorobenzamide
CID 24546452
N-[2-(tert-butylamino)-2-oxoethyl]-N-methylbutanamide
CID 60717641
2-[tert-butylcarbamoyl(ethyl)amino]-N-ethylacetamide
CID 115571895

Frequently Asked Questions

What is the IUPAC name of N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide?
The IUPAC name of N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide (CID 78790706) is N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide.
What is the SMILES notation for N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide?
The canonical SMILES for N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide is CCN(CC(=O)NC(C)(C)C)C(=O)CCC(C)C.
What is the InChIKey of N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide?
The InChIKey is NYSMLCNJWMOYOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-7-16(13(18)9-8-11(2)3)10-12(17)15-14(4,5)6/h11H,7-10H2,1-6H3,(H,15,17).
What are the key properties of N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide?
N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide has a molecular weight of 256.39 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-4-methylpentanamide is sourced from PubChem (CID 78790706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).