(NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine

C13H17NO2 — CID 6183979

IUPAC(NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine
SMILESCOc1cccc(C2CCCC/C2=N/O)c1
InChIInChI=1S/C13H17NO2/c1-16-11-6-4-5-10(9-11)12-7-2-3-8-13(12)14-15/h4-6,9,12,15H,2-3,7-8H2,1H3/b14-13-
InChIKeyCUDFEJYCSUPXKN-YPKPFQOOSA-N
MW219.28 g/mol
LogP3.18
Rot. Bonds2

About (NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine

(NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine (PubChem CID 6183979) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is (NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine
PubChem CID6183979
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name(NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine
SMILESCOc1cccc(C2CCCC/C2=N/O)c1
InChIInChI=1S/C13H17NO2/c1-16-11-6-4-5-10(9-11)12-7-2-3-8-13(12)14-15/h4-6,9,12,15H,2-3,7-8H2,1H3/b14-13-
InChIKeyCUDFEJYCSUPXKN-YPKPFQOOSA-N
XLogP3.18
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 53.18
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 (NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine (CID 6183979) is (NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine is COc1cccc(C2CCCC/C2=N/O)c1.
What is the InChIKey of (NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine?
The InChIKey is CUDFEJYCSUPXKN-YPKPFQOOSA-N. The full InChI is InChI=1S/C13H17NO2/c1-16-11-6-4-5-10(9-11)12-7-2-3-8-13(12)14-15/h4-6,9,12,15H,2-3,7-8H2,1H3/b14-13-.
What are the key properties of (NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine?
(NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine has a molecular weight of 219.28 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine is sourced from PubChem (CID 6183979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).