2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide

C12H24N2O3 — CID 113476033

IUPAC2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide
SMILESCC(=O)NC(C(=O)N(C)C(C)(C)CO)C(C)C
InChIInChI=1S/C12H24N2O3/c1-8(2)10(13-9(3)16)11(17)14(6)12(4,5)7-15/h8,10,15H,7H2,1-6H3,(H,13,16)
InChIKeyKPVIZBHOWPLTET-UHFFFAOYSA-N
MW244.33 g/mol
LogP0.38
Rot. Bonds5

About 2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide

2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide (PubChem CID 113476033) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is 2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide.

Molecular Properties

Compound Name2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide
PubChem CID113476033
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Name2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide
SMILESCC(=O)NC(C(=O)N(C)C(C)(C)CO)C(C)C
InChIInChI=1S/C12H24N2O3/c1-8(2)10(13-9(3)16)11(17)14(6)12(4,5)7-15/h8,10,15H,7H2,1-6H3,(H,13,16)
InChIKeyKPVIZBHOWPLTET-UHFFFAOYSA-N
XLogP0.38
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-acetamido-N-(2-hydroxypropyl)-N,3-dimethylbutanamide
CID 62334399
2-acetamido-N,N-diethyl-3-methylbutanamide
CID 60635909
2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 113239606
3-[(2-acetamido-3-methylbutanoyl)-tert-butylamino]propanoic acid
CID 60825146
(2R)-2-[[(1-hydroxy-2-methylpropan-2-yl)-methylcarbamoyl]amino]propanoic acid
CID 104864074
ethyl 2-[(2-acetamido-3-methylbutanoyl)-methylamino]acetate
CID 55003873
2-acetamido-3-methyl-N-(3-methylbutyl)butanamide
CID 78784334
(2S)-2-[[(1-hydroxy-2-methylpropan-2-yl)-methylcarbamoyl]amino]-3,3-dimethylbutanoic acid
CID 104864085
2-acetamido-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-3-methylbutanamide
CID 114010724
2-acetamido-N,3-dimethyl-N-[(4-methylphenyl)methyl]butanamide
CID 18114298
2-acetamido-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylbutanamide
CID 103839615
4-[(2-acetamido-3-methylbutanoyl)-methylamino]benzoic acid
CID 104698191

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide?
The IUPAC name of 2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide (CID 113476033) is 2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide.
What is the SMILES notation for 2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide?
The canonical SMILES for 2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide is CC(=O)NC(C(=O)N(C)C(C)(C)CO)C(C)C.
What is the InChIKey of 2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide?
The InChIKey is KPVIZBHOWPLTET-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-8(2)10(13-9(3)16)11(17)14(6)12(4,5)7-15/h8,10,15H,7H2,1-6H3,(H,13,16).
What are the key properties of 2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide?
2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide has a molecular weight of 244.33 g/mol, XLogP of 0.38, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(1-hydroxy-2-methylpropan-2-yl)-N,3-dimethylbutanamide is sourced from PubChem (CID 113476033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).