2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide

C12H26N2O2 — CID 91127730

IUPAC2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide
SMILESCCCC(C)(C)NC(=O)CN(O)C(C)(C)C
InChIInChI=1S/C12H26N2O2/c1-7-8-12(5,6)13-10(15)9-14(16)11(2,3)4/h16H,7-9H2,1-6H3,(H,13,15)
InChIKeyQFWDUECGJTYLQQ-UHFFFAOYSA-N
MW230.35 g/mol
LogP2.17
Rot. Bonds5

About 2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide

2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide (PubChem CID 91127730) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide.

Molecular Properties

Compound Name2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide
PubChem CID91127730
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide
SMILESCCCC(C)(C)NC(=O)CN(O)C(C)(C)C
InChIInChI=1S/C12H26N2O2/c1-7-8-12(5,6)13-10(15)9-14(16)11(2,3)4/h16H,7-9H2,1-6H3,(H,13,15)
InChIKeyQFWDUECGJTYLQQ-UHFFFAOYSA-N
XLogP2.17
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide?
The IUPAC name of 2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide (CID 91127730) is 2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide.
What is the SMILES notation for 2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide?
The canonical SMILES for 2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide is CCCC(C)(C)NC(=O)CN(O)C(C)(C)C.
What is the InChIKey of 2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide?
The InChIKey is QFWDUECGJTYLQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-7-8-12(5,6)13-10(15)9-14(16)11(2,3)4/h16H,7-9H2,1-6H3,(H,13,15).
What are the key properties of 2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide?
2-[tert-butyl(hydroxy)amino]-N-(2-methylpentan-2-yl)acetamide has a molecular weight of 230.35 g/mol, XLogP of 2.17, 5 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-(2-methylpentan-2-yl)acetamide is sourced from PubChem (CID 91127730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).