N-tert-butyl-N-cycloheptylhydroxylamine

C11H23NO — CID 121217843

IUPACN-tert-butyl-N-cycloheptylhydroxylamine
SMILESCC(C)(C)N(O)C1CCCCCC1
InChIInChI=1S/C11H23NO/c1-11(2,3)12(13)10-8-6-4-5-7-9-10/h10,13H,4-9H2,1-3H3
InChIKeyLONQNDXWVQGISH-UHFFFAOYSA-N
MW185.31 g/mol
LogP3.20
Rot. Bonds1

About N-tert-butyl-N-cycloheptylhydroxylamine

N-tert-butyl-N-cycloheptylhydroxylamine (PubChem CID 121217843) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-tert-butyl-N-cycloheptylhydroxylamine.

Molecular Properties

Compound NameN-tert-butyl-N-cycloheptylhydroxylamine
PubChem CID121217843
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-tert-butyl-N-cycloheptylhydroxylamine
SMILESCC(C)(C)N(O)C1CCCCCC1
InChIInChI=1S/C11H23NO/c1-11(2,3)12(13)10-8-6-4-5-7-9-10/h10,13H,4-9H2,1-3H3
InChIKeyLONQNDXWVQGISH-UHFFFAOYSA-N
XLogP3.20
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 N-tert-butyl-N-cycloheptylhydroxylamine?
The IUPAC name of N-tert-butyl-N-cycloheptylhydroxylamine (CID 121217843) is N-tert-butyl-N-cycloheptylhydroxylamine.
What is the SMILES notation for N-tert-butyl-N-cycloheptylhydroxylamine?
The canonical SMILES for N-tert-butyl-N-cycloheptylhydroxylamine is CC(C)(C)N(O)C1CCCCCC1.
What is the InChIKey of N-tert-butyl-N-cycloheptylhydroxylamine?
The InChIKey is LONQNDXWVQGISH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-11(2,3)12(13)10-8-6-4-5-7-9-10/h10,13H,4-9H2,1-3H3.
What are the key properties of N-tert-butyl-N-cycloheptylhydroxylamine?
N-tert-butyl-N-cycloheptylhydroxylamine has a molecular weight of 185.31 g/mol, XLogP of 3.20, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-N-cycloheptylhydroxylamine is sourced from PubChem (CID 121217843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).