N-tert-butyl-2-hydroxyacetamide

C6H13NO2 — CID 20795021

IUPACN-tert-butyl-2-hydroxyacetamide
SMILESCC(C)(C)NC(=O)CO
InChIInChI=1S/C6H13NO2/c1-6(2,3)7-5(9)4-8/h8H,4H2,1-3H3,(H,7,9)
InChIKeySGWCSGJBNVWDQO-UHFFFAOYSA-N
MW131.17 g/mol
LogP-0.11
Rot. Bonds1

About N-tert-butyl-2-hydroxyacetamide

N-tert-butyl-2-hydroxyacetamide (PubChem CID 20795021) has the molecular formula C6H13NO2 and a molecular weight of 131.17 g/mol. Its IUPAC name is N-tert-butyl-2-hydroxyacetamide.

Molecular Properties

Compound NameN-tert-butyl-2-hydroxyacetamide
PubChem CID20795021
Molecular FormulaC6H13NO2
Molecular Weight131.17 g/mol
Exact Mass131.09
IUPAC NameN-tert-butyl-2-hydroxyacetamide
SMILESCC(C)(C)NC(=O)CO
InChIInChI=1S/C6H13NO2/c1-6(2,3)7-5(9)4-8/h8H,4H2,1-3H3,(H,7,9)
InChIKeySGWCSGJBNVWDQO-UHFFFAOYSA-N
XLogP-0.11
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.17
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-hydroxyacetamide?
The IUPAC name of N-tert-butyl-2-hydroxyacetamide (CID 20795021) is N-tert-butyl-2-hydroxyacetamide.
What is the SMILES notation for N-tert-butyl-2-hydroxyacetamide?
The canonical SMILES for N-tert-butyl-2-hydroxyacetamide is CC(C)(C)NC(=O)CO.
What is the InChIKey of N-tert-butyl-2-hydroxyacetamide?
The InChIKey is SGWCSGJBNVWDQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-6(2,3)7-5(9)4-8/h8H,4H2,1-3H3,(H,7,9).
What are the key properties of N-tert-butyl-2-hydroxyacetamide?
N-tert-butyl-2-hydroxyacetamide has a molecular weight of 131.17 g/mol, XLogP of -0.11, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-hydroxyacetamide is sourced from PubChem (CID 20795021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).