(NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine

C16H12N2OSe — CID 136703535

IUPAC(NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine
SMILESO/N=C(/c1ccccc1)c1nc(-c2ccccc2)c[se]1
InChIInChI=1S/C16H12N2OSe/c19-18-15(13-9-5-2-6-10-13)16-17-14(11-20-16)12-7-3-1-4-8-12/h1-11,19H/b18-15-
InChIKeyXPOHGJBOADHDPK-SDXDJHTJSA-N
MW327.25 g/mol
LogP3.03
Rot. Bonds3

About (NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine

(NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine (PubChem CID 136703535) has the molecular formula C16H12N2OSe and a molecular weight of 327.25 g/mol. Its IUPAC name is (NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine
PubChem CID136703535
Molecular FormulaC16H12N2OSe
Molecular Weight327.25 g/mol
Exact Mass328.01
IUPAC Name(NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine
SMILESO/N=C(/c1ccccc1)c1nc(-c2ccccc2)c[se]1
InChIInChI=1S/C16H12N2OSe/c19-18-15(13-9-5-2-6-10-13)16-17-14(11-20-16)12-7-3-1-4-8-12/h1-11,19H/b18-15-
InChIKeyXPOHGJBOADHDPK-SDXDJHTJSA-N
XLogP3.03
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.25
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

(NZ)-N-[(4-methylphenyl)-phenylmethylidene]hydroxylamine
CID 6303063
2-(4-chlorophenyl)-4-phenyl-1,3-selenazole
CID 15468155
(2E,4E)-5-phenyl-2-(4-phenyl-1,3-selenazol-2-yl)penta-2,4-dienenitrile
CID 178066109
N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine
CID 15437866
N-[3,5-bis[[phenyl-(4-pyridin-2-ylphenyl)methylidene]amino]phenyl]-1-phenyl-1-(4-pyridin-2-ylphenyl)methanimine
CID 140904704
(NZ)-N-[phenyl(pyridin-2-yl)methylidene]hydroxylamine
CID 135427108
2-phenyl-4,6-bis(4-phenylphenyl)pyrimidine
CID 58604250
N-[1,3-benzoxazol-2-yl(phenyl)methylidene]hydroxylamine
CID 137201316
phenyl(1,3-thiazol-2-yl)methanone;(NE)-N-[phenyl(1,3-thiazol-2-yl)methylidene]hydroxylamine
CID 172917333
(NE)-N-[(2-methylphenyl)-phenylmethylidene]hydroxylamine
CID 12003652
(NZ)-N-[(2,6-dichlorophenyl)-phenylmethylidene]hydroxylamine
CID 101190052
(NE)-N-[[2-amino-3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-phenylmethylidene]hydroxylamine
CID 59879950

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine (CID 136703535) is (NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine is O/N=C(/c1ccccc1)c1nc(-c2ccccc2)c[se]1.
What is the InChIKey of (NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine?
The InChIKey is XPOHGJBOADHDPK-SDXDJHTJSA-N. The full InChI is InChI=1S/C16H12N2OSe/c19-18-15(13-9-5-2-6-10-13)16-17-14(11-20-16)12-7-3-1-4-8-12/h1-11,19H/b18-15-.
What are the key properties of (NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine?
(NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine has a molecular weight of 327.25 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[phenyl-(4-phenyl-1,3-selenazol-2-yl)methylidene]hydroxylamine is sourced from PubChem (CID 136703535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).