(NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine

C19H17NO3 — CID 122179765

IUPAC(NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine
SMILESCOc1ccc(/C(COc2ccc3ccccc3c2)=N/O)cc1
InChIInChI=1S/C19H17NO3/c1-22-17-9-7-15(8-10-17)19(20-21)13-23-18-11-6-14-4-2-3-5-16(14)12-18/h2-12,21H,13H2,1H3/b20-19+
InChIKeyGRYKYUAHFYQVFQ-FMQUCBEESA-N
MW307.35 g/mol
LogP4.11
Rot. Bonds5

About (NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine

(NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine (PubChem CID 122179765) has the molecular formula C19H17NO3 and a molecular weight of 307.35 g/mol. Its IUPAC name is (NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine
PubChem CID122179765
Molecular FormulaC19H17NO3
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC Name(NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine
SMILESCOc1ccc(/C(COc2ccc3ccccc3c2)=N/O)cc1
InChIInChI=1S/C19H17NO3/c1-22-17-9-7-15(8-10-17)19(20-21)13-23-18-11-6-14-4-2-3-5-16(14)12-18/h2-12,21H,13H2,1H3/b20-19+
InChIKeyGRYKYUAHFYQVFQ-FMQUCBEESA-N
XLogP4.11
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine (CID 122179765) is (NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine is COc1ccc(/C(COc2ccc3ccccc3c2)=N/O)cc1.
What is the InChIKey of (NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine?
The InChIKey is GRYKYUAHFYQVFQ-FMQUCBEESA-N. The full InChI is InChI=1S/C19H17NO3/c1-22-17-9-7-15(8-10-17)19(20-21)13-23-18-11-6-14-4-2-3-5-16(14)12-18/h2-12,21H,13H2,1H3/b20-19+.
What are the key properties of (NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine?
(NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine has a molecular weight of 307.35 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-(4-methoxyphenyl)-2-naphthalen-2-yloxyethylidene]hydroxylamine is sourced from PubChem (CID 122179765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).