(NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine

C19H17NO2 — CID 42312904

IUPAC(NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine
SMILESCc1ccccc1COc1ccc2ccccc2c1/C=N/O
InChIInChI=1S/C19H17NO2/c1-14-6-2-3-8-16(14)13-22-19-11-10-15-7-4-5-9-17(15)18(19)12-20-21/h2-12,21H,13H2,1H3/b20-12+
InChIKeyWLDMTLQZQRDOMR-UDWIEESQSA-N
MW291.35 g/mol
LogP4.54
Rot. Bonds4

About (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine

(NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine (PubChem CID 42312904) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine
PubChem CID42312904
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC Name(NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine
SMILESCc1ccccc1COc1ccc2ccccc2c1/C=N/O
InChIInChI=1S/C19H17NO2/c1-14-6-2-3-8-16(14)13-22-19-11-10-15-7-4-5-9-17(15)18(19)12-20-21/h2-12,21H,13H2,1H3/b20-12+
InChIKeyWLDMTLQZQRDOMR-UDWIEESQSA-N
XLogP4.54
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 54.54
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'}

Analyze (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-phenylmethoxynaphthalen-1-yl)methylidene]hydroxylamine
CID 807879
N-[(2-methoxynaphthalen-1-yl)methylidene]hydroxylamine
CID 708036
1-benzyl-3-[(E)-[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylideneamino]thiourea
CID 110339323
N-(4-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)naphthalen-1-yl]methanimine
CID 126215977
N-[[2-(2-phenylethoxy)naphthalen-1-yl]methylidene]hydroxylamine
CID 20990812
(NZ)-N-[[3-methoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]hydroxylamine
CID 91681827
(NZ)-N-[[3-bromo-4-[(2-methylphenyl)methoxy]phenyl]methylidene]hydroxylamine
CID 91681880
1-[2-(naphthalen-1-ylmethoxy)naphthalen-1-yl]-N-phenylmethanimine
CID 126215170
N-(3,4-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methanimine
CID 126218669
N-(3-chloro-4-methylphenyl)-1-[2-[(2-chlorophenyl)methoxy]naphthalen-1-yl]methanimine
CID 126210028
ethyl 6-[1-(hydroxyiminomethyl)naphthalen-2-yl]oxyhexanoate
CID 86662492
2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylideneamino]acetamide
CID 46300582

Frequently Asked Questions

What is the IUPAC name of (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine?
The IUPAC name of (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine (CID 42312904) is (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine is Cc1ccccc1COc1ccc2ccccc2c1/C=N/O.
What is the InChIKey of (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine?
The InChIKey is WLDMTLQZQRDOMR-UDWIEESQSA-N. The full InChI is InChI=1S/C19H17NO2/c1-14-6-2-3-8-16(14)13-22-19-11-10-15-7-4-5-9-17(15)18(19)12-20-21/h2-12,21H,13H2,1H3/b20-12+.
What are the key properties of (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine?
(NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine has a molecular weight of 291.35 g/mol, XLogP of 4.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-[[2-[(2-methylphenyl)methoxy]naphthalen-1-yl]methylidene]hydroxylamine is sourced from PubChem (CID 42312904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).