O-(1-adamantyl)hydroxylamine;hydrochloride

C10H18ClNO — CID 70694452

IUPACO-(1-adamantyl)hydroxylamine;hydrochloride
SMILESCl.NOC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C10H17NO.ClH/c11-12-10-4-7-1-8(5-10)3-9(2-7)6-10;/h7-9H,1-6,11H2;1H
InChIKeyDNPFNQAENPNQSG-UHFFFAOYSA-N
MW203.71 g/mol
LogP2.27
Rot. Bonds1

About O-(1-adamantyl)hydroxylamine;hydrochloride

O-(1-adamantyl)hydroxylamine;hydrochloride (PubChem CID 70694452) has the molecular formula C10H18ClNO and a molecular weight of 203.71 g/mol. Its IUPAC name is O-(1-adamantyl)hydroxylamine;hydrochloride.

Molecular Properties

Compound NameO-(1-adamantyl)hydroxylamine;hydrochloride
PubChem CID70694452
Molecular FormulaC10H18ClNO
Molecular Weight203.71 g/mol
Exact Mass203.11
IUPAC NameO-(1-adamantyl)hydroxylamine;hydrochloride
SMILESCl.NOC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C10H17NO.ClH/c11-12-10-4-7-1-8(5-10)3-9(2-7)6-10;/h7-9H,1-6,11H2;1H
InChIKeyDNPFNQAENPNQSG-UHFFFAOYSA-N
XLogP2.27
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.71
LogP ≤ 52.27
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 O-(1-adamantyl)hydroxylamine;hydrochloride?
The IUPAC name of O-(1-adamantyl)hydroxylamine;hydrochloride (CID 70694452) is O-(1-adamantyl)hydroxylamine;hydrochloride.
What is the SMILES notation for O-(1-adamantyl)hydroxylamine;hydrochloride?
The canonical SMILES for O-(1-adamantyl)hydroxylamine;hydrochloride is Cl.NOC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of O-(1-adamantyl)hydroxylamine;hydrochloride?
The InChIKey is DNPFNQAENPNQSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO.ClH/c11-12-10-4-7-1-8(5-10)3-9(2-7)6-10;/h7-9H,1-6,11H2;1H.
What are the key properties of O-(1-adamantyl)hydroxylamine;hydrochloride?
O-(1-adamantyl)hydroxylamine;hydrochloride has a molecular weight of 203.71 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-(1-adamantyl)hydroxylamine;hydrochloride is sourced from PubChem (CID 70694452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).