N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine

C10H18N2O — CID 88827506

IUPACN-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine
SMILESCCN(CC)C1=CCCCC1=NO
InChIInChI=1S/C10H18N2O/c1-3-12(4-2)10-8-6-5-7-9(10)11-13/h8,13H,3-7H2,1-2H3
InChIKeyQNDNZRVXDBYFQV-UHFFFAOYSA-N
MW182.27 g/mol
LogP2.23
Rot. Bonds3

About N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine

N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine (PubChem CID 88827506) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine.

Molecular Properties

Compound NameN-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine
PubChem CID88827506
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine
SMILESCCN(CC)C1=CCCCC1=NO
InChIInChI=1S/C10H18N2O/c1-3-12(4-2)10-8-6-5-7-9(10)11-13/h8,13H,3-7H2,1-2H3
InChIKeyQNDNZRVXDBYFQV-UHFFFAOYSA-N
XLogP2.23
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine?
The IUPAC name of N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine (CID 88827506) is N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine.
What is the SMILES notation for N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine?
The canonical SMILES for N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine is CCN(CC)C1=CCCCC1=NO.
What is the InChIKey of N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine?
The InChIKey is QNDNZRVXDBYFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-3-12(4-2)10-8-6-5-7-9(10)11-13/h8,13H,3-7H2,1-2H3.
What are the key properties of N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine?
N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine has a molecular weight of 182.27 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)cyclohex-2-en-1-ylidene]hydroxylamine is sourced from PubChem (CID 88827506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).