N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine

C18H15NO2 — CID 807879

IUPACN-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine
SMILESON=Cc1c(OCc2ccccc2)ccc2ccccc12
InChIInChI=1S/C18H15NO2/c20-19-12-17-16-9-5-4-8-15(16)10-11-18(17)21-13-14-6-2-1-3-7-14/h1-12,20H,13H2
InChIKeyGODSLXIRMVBKLE-UHFFFAOYSA-N
MW277.32 g/mol
LogP4.23
Rot. Bonds4

About N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine

N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine (PubChem CID 807879) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine.

Molecular Properties

Compound NameN-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine
PubChem CID807879
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC NameN-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine
SMILESON=Cc1c(OCc2ccccc2)ccc2ccccc12
InChIInChI=1S/C18H15NO2/c20-19-12-17-16-9-5-4-8-15(16)10-11-18(17)21-13-14-6-2-1-3-7-14/h1-12,20H,13H2
InChIKeyGODSLXIRMVBKLE-UHFFFAOYSA-N
XLogP4.23
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 54.23
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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Related Compounds

N-[[2-(2-phenylethoxy)naphthalen-1-yl]methylidene]hydroxylamine
CID 20990812
(NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine
CID 42312904
N-(4-bromophenyl)-1-(2-phenylmethoxynaphthalen-1-yl)methanimine
CID 4779325
4-chloro-N-[(2-phenylmethoxynaphthalen-1-yl)methylideneamino]aniline
CID 110840761
N-[(2-methoxynaphthalen-1-yl)methylidene]hydroxylamine
CID 708036
1-methyl-3-[(E)-(2-phenylmethoxynaphthalen-1-yl)methylideneamino]thiourea
CID 7346399
1-[2-[(4-bromophenyl)methoxy]naphthalen-1-yl]-N-phenylmethanimine
CID 126208478
N-phenyl-N'-[(2-phenylmethoxynaphthalen-1-yl)methylideneamino]propanediamide
CID 3675600
2-bromo-N-[(Z)-(2-phenylmethoxynaphthalen-1-yl)methylideneamino]benzamide
CID 29147296
1,2-bis(phenylmethoxy)naphthalene
CID 67710722
N'-[(Z)-(2-phenylmethoxynaphthalen-1-yl)methylideneamino]-N-prop-2-enyloxamide
CID 8901914
1-(3,4-dimethoxyphenyl)-N-[(Z)-(2-phenylmethoxynaphthalen-1-yl)methylideneamino]methanamine
CID 92658541

Frequently Asked Questions

What is the IUPAC name of N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine?
The IUPAC name of N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine (CID 807879) is N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine.
What is the SMILES notation for N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine?
The canonical SMILES for N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine is ON=Cc1c(OCc2ccccc2)ccc2ccccc12.
What is the InChIKey of N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine?
The InChIKey is GODSLXIRMVBKLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO2/c20-19-12-17-16-9-5-4-8-15(16)10-11-18(17)21-13-14-6-2-1-3-7-14/h1-12,20H,13H2.
What are the key properties of N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine?
N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine has a molecular weight of 277.32 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine is sourced from PubChem (CID 807879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).