N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine

C11H21NO — CID 15300725

IUPACN-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine
SMILESCCC(C)(C)C1CCC(=NO)CC1
InChIInChI=1S/C11H21NO/c1-4-11(2,3)9-5-7-10(12-13)8-6-9/h9,13H,4-8H2,1-3H3/b12-10-
InChIKeyLLMPSANKEHVNNR-BENRWUELSA-N
MW183.30 g/mol
LogP3.44
Rot. Bonds2

About N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine

N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine (PubChem CID 15300725) has the molecular formula C11H21NO and a molecular weight of 183.30 g/mol. Its IUPAC name is N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine.

Molecular Properties

Compound NameN-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine
PubChem CID15300725
Molecular FormulaC11H21NO
Molecular Weight183.30 g/mol
Exact Mass183.16
IUPAC NameN-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine
SMILESCCC(C)(C)C1CCC(=NO)CC1
InChIInChI=1S/C11H21NO/c1-4-11(2,3)9-5-7-10(12-13)8-6-9/h9,13H,4-8H2,1-3H3/b12-10-
InChIKeyLLMPSANKEHVNNR-BENRWUELSA-N
XLogP3.44
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 53.44
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-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine?
The IUPAC name of N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine (CID 15300725) is N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine.
What is the SMILES notation for N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine?
The canonical SMILES for N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine is CCC(C)(C)C1CCC(=NO)CC1.
What is the InChIKey of N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine?
The InChIKey is LLMPSANKEHVNNR-BENRWUELSA-N. The full InChI is InChI=1S/C11H21NO/c1-4-11(2,3)9-5-7-10(12-13)8-6-9/h9,13H,4-8H2,1-3H3/b12-10-.
What are the key properties of N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine?
N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine has a molecular weight of 183.30 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methylbutan-2-yl)cyclohexylidene]hydroxylamine is sourced from PubChem (CID 15300725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).