N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide

C11H24N2O2 — CID 107649223

IUPACN-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide
SMILESCCN(C)C(=O)CNCC(C)(CC)CO
InChIInChI=1S/C11H24N2O2/c1-5-11(3,9-14)8-12-7-10(15)13(4)6-2/h12,14H,5-9H2,1-4H3
InChIKeyCCTXIXBADQEJHV-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.46
Rot. Bonds7

About N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide

N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide (PubChem CID 107649223) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide.

Molecular Properties

Compound NameN-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide
PubChem CID107649223
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide
SMILESCCN(C)C(=O)CNCC(C)(CC)CO
InChIInChI=1S/C11H24N2O2/c1-5-11(3,9-14)8-12-7-10(15)13(4)6-2/h12,14H,5-9H2,1-4H3
InChIKeyCCTXIXBADQEJHV-UHFFFAOYSA-N
XLogP0.46
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N,N-dimethylacetamide
CID 81412798
N-ethyl-2-[(2-ethyl-2-hydroxybutyl)amino]-N-methylacetamide
CID 65111085
2-[(2-ethoxy-2-methylpropyl)amino]-N-ethyl-N-methylacetamide
CID 114941885
2-[[2-[ethyl(methyl)amino]ethylamino]methyl]-2-methylbutan-1-ol
CID 81419046
3-[2-[[2-(hydroxymethyl)-2-methylbutyl]amino]ethyl]-1,1-dimethylurea
CID 83116818
2-[[2-ethyl-2-(hydroxymethyl)butyl]amino]-N,N-dimethylacetamide
CID 81412872
N-ethyl-2-(5-hydroxypentylamino)-N-methylacetamide
CID 107317457
N-ethyl-N-methyl-2-(methylamino)acetamide
CID 18683928
3-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]-2-hydroxypropanamide
CID 106174842
tert-butyl N-[3-[[2-(hydroxymethyl)-2-methylbutyl]amino]-2-methylpropyl]-N-methylcarbamate
CID 107246629
2-[(2-aminoethylamino)methyl]-2-methylbutan-1-ol
CID 81418901
2-(2,2-dimethylpropylamino)-N,N-diethylacetamide
CID 61167034

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide?
The IUPAC name of N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide (CID 107649223) is N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide.
What is the SMILES notation for N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide?
The canonical SMILES for N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide is CCN(C)C(=O)CNCC(C)(CC)CO.
What is the InChIKey of N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide?
The InChIKey is CCTXIXBADQEJHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-5-11(3,9-14)8-12-7-10(15)13(4)6-2/h12,14H,5-9H2,1-4H3.
What are the key properties of N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide?
N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide has a molecular weight of 216.32 g/mol, XLogP of 0.46, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[2-(hydroxymethyl)-2-methylbutyl]amino]-N-methylacetamide is sourced from PubChem (CID 107649223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).