(NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine

C21H21N3O3 — CID 56672812

IUPAC(NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine
SMILESCc1ccc(/C(=N/O)N2CCOCC2)c(Oc2ccc3ccccc3c2)n1
InChIInChI=1S/C21H21N3O3/c1-15-6-9-19(20(23-25)24-10-12-26-13-11-24)21(22-15)27-18-8-7-16-4-2-3-5-17(16)14-18/h2-9,14,25H,10-13H2,1H3/b23-20-
InChIKeyPOWXPNRTFNFHOC-ATJXCDBQSA-N
MW363.42 g/mol
LogP3.80
Rot. Bonds3

About (NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine

(NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine (PubChem CID 56672812) has the molecular formula C21H21N3O3 and a molecular weight of 363.42 g/mol. Its IUPAC name is (NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine
PubChem CID56672812
Molecular FormulaC21H21N3O3
Molecular Weight363.42 g/mol
Exact Mass363.16
IUPAC Name(NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine
SMILESCc1ccc(/C(=N/O)N2CCOCC2)c(Oc2ccc3ccccc3c2)n1
InChIInChI=1S/C21H21N3O3/c1-15-6-9-19(20(23-25)24-10-12-26-13-11-24)21(22-15)27-18-8-7-16-4-2-3-5-17(16)14-18/h2-9,14,25H,10-13H2,1H3/b23-20-
InChIKeyPOWXPNRTFNFHOC-ATJXCDBQSA-N
XLogP3.80
TPSA67.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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

(NZ)-N-[[6-methyl-2-(4-methylphenoxy)-3-pyridinyl]-morpholin-4-ylmethylidene]hydroxylamine
CID 56676187
6-methyl-2-naphthalen-2-yloxypyridin-3-amine
CID 81131887
(NZ)-N-[(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-[6-methyl-2-(4-methylsulfanylphenoxy)-3-pyridinyl]methylidene]hydroxylamine
CID 56678920
(NZ)-N-[[2-[(3-fluorophenyl)methoxy]-6-methyl-3-pyridinyl]-(4-methylpiperidin-1-yl)methylidene]hydroxylamine
CID 56679498
N'-hydroxy-2-(4-methoxyphenoxy)-6-methylpyridine-3-carboximidamide
CID 56675946
2-(3-fluoro-4-methylphenoxy)-N'-hydroxy-6-methylpyridine-3-carboximidamide
CID 107169383
morpholin-4-yl(naphthalen-2-yl)methanimine
CID 63179433
N'-[(4-methoxyphenyl)-phenylmethyl]morpholine-4-carboximidamide
CID 21312379
N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride
CID 71370220
2-(3-fluorophenoxy)-N'-hydroxy-N,6-dimethyl-N-phenylpyridine-3-carboximidamide
CID 56675749
[4-methoxy-2-(2-methylsulfanylethoxy)phenyl]-morpholin-4-ylmethanethione
CID 54471594
N'-(4,6-dimethylpyrimidin-2-yl)morpholine-4-carboximidamide;hydrochloride
CID 126476570

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine (CID 56672812) is (NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine is Cc1ccc(/C(=N/O)N2CCOCC2)c(Oc2ccc3ccccc3c2)n1.
What is the InChIKey of (NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine?
The InChIKey is POWXPNRTFNFHOC-ATJXCDBQSA-N. The full InChI is InChI=1S/C21H21N3O3/c1-15-6-9-19(20(23-25)24-10-12-26-13-11-24)21(22-15)27-18-8-7-16-4-2-3-5-17(16)14-18/h2-9,14,25H,10-13H2,1H3/b23-20-.
What are the key properties of (NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine?
(NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine has a molecular weight of 363.42 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(6-methyl-2-naphthalen-2-yloxy-3-pyridinyl)-morpholin-4-ylmethylidene]hydroxylamine is sourced from PubChem (CID 56672812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).