N-(2,4-dimethylcyclohexylidene)hydroxylamine

C8H15NO — CID 77052929

IUPACN-(2,4-dimethylcyclohexylidene)hydroxylamine
SMILESCC1CCC(=NO)C(C)C1
InChIInChI=1S/C8H15NO/c1-6-3-4-8(9-10)7(2)5-6/h6-7,10H,3-5H2,1-2H3
InChIKeyXYJPFBJBHUORLA-UHFFFAOYSA-N
MW141.21 g/mol
LogP2.27
Rot. Bonds

About N-(2,4-dimethylcyclohexylidene)hydroxylamine

N-(2,4-dimethylcyclohexylidene)hydroxylamine (PubChem CID 77052929) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-(2,4-dimethylcyclohexylidene)hydroxylamine.

Molecular Properties

Compound NameN-(2,4-dimethylcyclohexylidene)hydroxylamine
PubChem CID77052929
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-(2,4-dimethylcyclohexylidene)hydroxylamine
SMILESCC1CCC(=NO)C(C)C1
InChIInChI=1S/C8H15NO/c1-6-3-4-8(9-10)7(2)5-6/h6-7,10H,3-5H2,1-2H3
InChIKeyXYJPFBJBHUORLA-UHFFFAOYSA-N
XLogP2.27
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-(2,4-dimethylcyclohexylidene)hydroxylamine?
The IUPAC name of N-(2,4-dimethylcyclohexylidene)hydroxylamine (CID 77052929) is N-(2,4-dimethylcyclohexylidene)hydroxylamine.
What is the SMILES notation for N-(2,4-dimethylcyclohexylidene)hydroxylamine?
The canonical SMILES for N-(2,4-dimethylcyclohexylidene)hydroxylamine is CC1CCC(=NO)C(C)C1.
What is the InChIKey of N-(2,4-dimethylcyclohexylidene)hydroxylamine?
The InChIKey is XYJPFBJBHUORLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-6-3-4-8(9-10)7(2)5-6/h6-7,10H,3-5H2,1-2H3.
What are the key properties of N-(2,4-dimethylcyclohexylidene)hydroxylamine?
N-(2,4-dimethylcyclohexylidene)hydroxylamine has a molecular weight of 141.21 g/mol, XLogP of 2.27, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylcyclohexylidene)hydroxylamine is sourced from PubChem (CID 77052929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).