2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide

C12H25NO2 — CID 20565975

IUPAC2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide
SMILESCCC(CC)(CC)C(=O)NC(C)(C)CO
InChIInChI=1S/C12H25NO2/c1-6-12(7-2,8-3)10(15)13-11(4,5)9-14/h14H,6-9H2,1-5H3,(H,13,15)
InChIKeyDAEKQBAKLXIBNG-UHFFFAOYSA-N
MW215.34 g/mol
LogP2.09
Rot. Bonds6

About 2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide

2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide (PubChem CID 20565975) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide.

Molecular Properties

Compound Name2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide
PubChem CID20565975
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide
SMILESCCC(CC)(CC)C(=O)NC(C)(C)CO
InChIInChI=1S/C12H25NO2/c1-6-12(7-2,8-3)10(15)13-11(4,5)9-14/h14H,6-9H2,1-5H3,(H,13,15)
InChIKeyDAEKQBAKLXIBNG-UHFFFAOYSA-N
XLogP2.09
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide?
The IUPAC name of 2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide (CID 20565975) is 2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide.
What is the SMILES notation for 2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide?
The canonical SMILES for 2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide is CCC(CC)(CC)C(=O)NC(C)(C)CO.
What is the InChIKey of 2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide?
The InChIKey is DAEKQBAKLXIBNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-6-12(7-2,8-3)10(15)13-11(4,5)9-14/h14H,6-9H2,1-5H3,(H,13,15).
What are the key properties of 2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide?
2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide has a molecular weight of 215.34 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide is sourced from PubChem (CID 20565975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).