N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine

C10H22N2O — CID 171384400

IUPACN-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine
SMILESCC(=NO)C(C)(C)CCCCCN
InChIInChI=1S/C10H22N2O/c1-9(12-13)10(2,3)7-5-4-6-8-11/h13H,4-8,11H2,1-3H3
InChIKeyWDEVISCQUPCFDH-UHFFFAOYSA-N
MW186.30 g/mol
LogP2.38
Rot. Bonds6

About N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine

N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine (PubChem CID 171384400) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine
PubChem CID171384400
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine
SMILESCC(=NO)C(C)(C)CCCCCN
InChIInChI=1S/C10H22N2O/c1-9(12-13)10(2,3)7-5-4-6-8-11/h13H,4-8,11H2,1-3H3
InChIKeyWDEVISCQUPCFDH-UHFFFAOYSA-N
XLogP2.38
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine?
The IUPAC name of N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine (CID 171384400) is N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine.
What is the SMILES notation for N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine?
The canonical SMILES for N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine is CC(=NO)C(C)(C)CCCCCN.
What is the InChIKey of N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine?
The InChIKey is WDEVISCQUPCFDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(12-13)10(2,3)7-5-4-6-8-11/h13H,4-8,11H2,1-3H3.
What are the key properties of N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine?
N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine has a molecular weight of 186.30 g/mol, XLogP of 2.38, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-amino-3,3-dimethyloctan-2-ylidene)hydroxylamine is sourced from PubChem (CID 171384400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).