N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine

C19H22N2O — CID 141139438

IUPACN-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine
SMILESON=C1CCC(NC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C19H22N2O/c22-21-18-13-11-17(12-14-18)20-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,17,19-20,22H,11-14H2/b21-18-
InChIKeyLEGUJYQWEFKLID-UZYVYHOESA-N
MW294.40 g/mol
LogP4.14
Rot. Bonds4

About N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine

N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine (PubChem CID 141139438) has the molecular formula C19H22N2O and a molecular weight of 294.40 g/mol. Its IUPAC name is N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine.

Molecular Properties

Compound NameN-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine
PubChem CID141139438
Molecular FormulaC19H22N2O
Molecular Weight294.40 g/mol
Exact Mass294.17
IUPAC NameN-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine
SMILESON=C1CCC(NC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C19H22N2O/c22-21-18-13-11-17(12-14-18)20-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,17,19-20,22H,11-14H2/b21-18-
InChIKeyLEGUJYQWEFKLID-UZYVYHOESA-N
XLogP4.14
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 54.14
H-Bond Donors ≤ 52
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-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine?
The IUPAC name of N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine (CID 141139438) is N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine.
What is the SMILES notation for N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine?
The canonical SMILES for N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine is ON=C1CCC(NC(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine?
The InChIKey is LEGUJYQWEFKLID-UZYVYHOESA-N. The full InChI is InChI=1S/C19H22N2O/c22-21-18-13-11-17(12-14-18)20-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,17,19-20,22H,11-14H2/b21-18-.
What are the key properties of N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine?
N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine has a molecular weight of 294.40 g/mol, XLogP of 4.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(benzhydrylamino)cyclohexylidene]hydroxylamine is sourced from PubChem (CID 141139438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).