N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide

C12H26N2O2 — CID 81482511

IUPACN-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide
SMILESCCC(N)(CC)CNC(=O)CC(C)COC
InChIInChI=1S/C12H26N2O2/c1-5-12(13,6-2)9-14-11(15)7-10(3)8-16-4/h10H,5-9,13H2,1-4H3,(H,14,15)
InChIKeyGJEJARIKRRSGAU-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.29
Rot. Bonds8

About N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide

N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide (PubChem CID 81482511) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide
PubChem CID81482511
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide
SMILESCCC(N)(CC)CNC(=O)CC(C)COC
InChIInChI=1S/C12H26N2O2/c1-5-12(13,6-2)9-14-11(15)7-10(3)8-16-4/h10H,5-9,13H2,1-4H3,(H,14,15)
InChIKeyGJEJARIKRRSGAU-UHFFFAOYSA-N
XLogP1.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-amino-2,2-dimethylpentyl)-4-methoxy-3-methylbutanamide
CID 106140831
N-(3-amino-2-hydroxy-3-oxopropyl)-4-methoxy-3-methylbutanamide
CID 106164776
N-(2-amino-2-ethylbutyl)-3-(4-methylpentan-2-yloxy)propanamide
CID 119643447
N-(3-hydroxy-2-methylpropyl)-4-methoxy-3-methylbutanamide;yttrium
CID 58776208
N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride
CID 119641121
N-[2-(2-aminoethyl)pentyl]-4-methoxy-3-methylbutanamide
CID 106116087
(2S)-N-(2-amino-2-ethylbutyl)-2-[(2-methoxyacetyl)amino]-3-methylbutanamide
CID 119641747
N-(2-amino-2-ethylbutyl)-2-ethoxyacetamide;hydrochloride
CID 119642392
N-(2-amino-2-ethylbutyl)-2-butoxyacetamide
CID 119640904
N-(2-amino-2-methylpropyl)-3,5,5-trimethylhexanamide
CID 115303265
N-(2-amino-2-ethylbutyl)-2-methoxy-2-methylpropanamide
CID 103021621
N-(2-ethyl-2-hydroxybutyl)-3-methylpentanamide
CID 114875415

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide?
The IUPAC name of N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide (CID 81482511) is N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide?
The canonical SMILES for N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide is CCC(N)(CC)CNC(=O)CC(C)COC.
What is the InChIKey of N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide?
The InChIKey is GJEJARIKRRSGAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-5-12(13,6-2)9-14-11(15)7-10(3)8-16-4/h10H,5-9,13H2,1-4H3,(H,14,15).
What are the key properties of N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide?
N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide has a molecular weight of 230.35 g/mol, XLogP of 1.29, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)-4-methoxy-3-methylbutanamide is sourced from PubChem (CID 81482511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).