2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide

C9H20N2O2 — CID 58691090

IUPAC2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN(O)C(C)(C)C
InChIInChI=1S/C9H20N2O2/c1-7(2)10-8(12)6-11(13)9(3,4)5/h7,13H,6H2,1-5H3,(H,10,12)
InChIKeyGCAWMDCKMPLBKT-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.00
Rot. Bonds3

About 2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide

2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide (PubChem CID 58691090) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide
PubChem CID58691090
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN(O)C(C)(C)C
InChIInChI=1S/C9H20N2O2/c1-7(2)10-8(12)6-11(13)9(3,4)5/h7,13H,6H2,1-5H3,(H,10,12)
InChIKeyGCAWMDCKMPLBKT-UHFFFAOYSA-N
XLogP1.00
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide (CID 58691090) is 2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide is CC(C)NC(=O)CN(O)C(C)(C)C.
What is the InChIKey of 2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide?
The InChIKey is GCAWMDCKMPLBKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-7(2)10-8(12)6-11(13)9(3,4)5/h7,13H,6H2,1-5H3,(H,10,12).
What are the key properties of 2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide?
2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide has a molecular weight of 188.27 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 58691090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).