N-(1-adamantylmethyl)hydroxylamine

C11H19NO — CID 87282911

IUPACN-(1-adamantylmethyl)hydroxylamine
SMILESONCC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C11H19NO/c13-12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10,12-13H,1-7H2
InChIKeyYDLXBNKWSSFETC-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.18
Rot. Bonds2

About N-(1-adamantylmethyl)hydroxylamine

N-(1-adamantylmethyl)hydroxylamine (PubChem CID 87282911) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is N-(1-adamantylmethyl)hydroxylamine.

Molecular Properties

Compound NameN-(1-adamantylmethyl)hydroxylamine
PubChem CID87282911
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC NameN-(1-adamantylmethyl)hydroxylamine
SMILESONCC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C11H19NO/c13-12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10,12-13H,1-7H2
InChIKeyYDLXBNKWSSFETC-UHFFFAOYSA-N
XLogP2.18
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.18
H-Bond Donors ≤ 52
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-(1-adamantylmethyl)hydroxylamine?
The IUPAC name of N-(1-adamantylmethyl)hydroxylamine (CID 87282911) is N-(1-adamantylmethyl)hydroxylamine.
What is the SMILES notation for N-(1-adamantylmethyl)hydroxylamine?
The canonical SMILES for N-(1-adamantylmethyl)hydroxylamine is ONCC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-(1-adamantylmethyl)hydroxylamine?
The InChIKey is YDLXBNKWSSFETC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c13-12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10,12-13H,1-7H2.
What are the key properties of N-(1-adamantylmethyl)hydroxylamine?
N-(1-adamantylmethyl)hydroxylamine has a molecular weight of 181.28 g/mol, XLogP of 2.18, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantylmethyl)hydroxylamine is sourced from PubChem (CID 87282911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).