N-(2-butylidenecyclohexylidene)hydroxylamine

C10H17NO — CID 88733504

IUPACN-(2-butylidenecyclohexylidene)hydroxylamine
SMILESCCCC=C1CCCCC1=NO
InChIInChI=1S/C10H17NO/c1-2-3-6-9-7-4-5-8-10(9)11-12/h6,12H,2-5,7-8H2,1H3
InChIKeyAFDZZRDDPSLYLX-UHFFFAOYSA-N
MW167.25 g/mol
LogP3.12
Rot. Bonds2

About N-(2-butylidenecyclohexylidene)hydroxylamine

N-(2-butylidenecyclohexylidene)hydroxylamine (PubChem CID 88733504) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is N-(2-butylidenecyclohexylidene)hydroxylamine.

Molecular Properties

Compound NameN-(2-butylidenecyclohexylidene)hydroxylamine
PubChem CID88733504
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC NameN-(2-butylidenecyclohexylidene)hydroxylamine
SMILESCCCC=C1CCCCC1=NO
InChIInChI=1S/C10H17NO/c1-2-3-6-9-7-4-5-8-10(9)11-12/h6,12H,2-5,7-8H2,1H3
InChIKeyAFDZZRDDPSLYLX-UHFFFAOYSA-N
XLogP3.12
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 53.12
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-butylidenecyclohexylidene)hydroxylamine?
The IUPAC name of N-(2-butylidenecyclohexylidene)hydroxylamine (CID 88733504) is N-(2-butylidenecyclohexylidene)hydroxylamine.
What is the SMILES notation for N-(2-butylidenecyclohexylidene)hydroxylamine?
The canonical SMILES for N-(2-butylidenecyclohexylidene)hydroxylamine is CCCC=C1CCCCC1=NO.
What is the InChIKey of N-(2-butylidenecyclohexylidene)hydroxylamine?
The InChIKey is AFDZZRDDPSLYLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-2-3-6-9-7-4-5-8-10(9)11-12/h6,12H,2-5,7-8H2,1H3.
What are the key properties of N-(2-butylidenecyclohexylidene)hydroxylamine?
N-(2-butylidenecyclohexylidene)hydroxylamine has a molecular weight of 167.25 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butylidenecyclohexylidene)hydroxylamine is sourced from PubChem (CID 88733504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).