N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine

C10H20N2O — CID 175196118

IUPACN-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine
SMILESCC1(C)CC(C=NO)CC(C)(C)N1
InChIInChI=1S/C10H20N2O/c1-9(2)5-8(7-11-13)6-10(3,4)12-9/h7-8,12-13H,5-6H2,1-4H3
InChIKeyNTTHJHPSNPSONV-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.00
Rot. Bonds1

About N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine

N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine (PubChem CID 175196118) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine.

Molecular Properties

Compound NameN-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine
PubChem CID175196118
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine
SMILESCC1(C)CC(C=NO)CC(C)(C)N1
InChIInChI=1S/C10H20N2O/c1-9(2)5-8(7-11-13)6-10(3,4)12-9/h7-8,12-13H,5-6H2,1-4H3
InChIKeyNTTHJHPSNPSONV-UHFFFAOYSA-N
XLogP2.00
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine?
The IUPAC name of N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine (CID 175196118) is N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine.
What is the SMILES notation for N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine?
The canonical SMILES for N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine is CC1(C)CC(C=NO)CC(C)(C)N1.
What is the InChIKey of N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine?
The InChIKey is NTTHJHPSNPSONV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-9(2)5-8(7-11-13)6-10(3,4)12-9/h7-8,12-13H,5-6H2,1-4H3.
What are the key properties of N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine?
N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine has a molecular weight of 184.28 g/mol, XLogP of 2.00, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2,6,6-tetramethylpiperidin-4-yl)methylidene]hydroxylamine is sourced from PubChem (CID 175196118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).