(NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine

C19H17N3O2S — CID 56665548

IUPAC(NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine
SMILESO/N=C(/c1cccnc1Oc1ccc2ccccc2c1)N1CCSC1
InChIInChI=1S/C19H17N3O2S/c23-21-18(22-10-11-25-13-22)17-6-3-9-20-19(17)24-16-8-7-14-4-1-2-5-15(14)12-16/h1-9,12,23H,10-11,13H2/b21-18-
InChIKeyZWHQZQVJPKQJNV-UZYVYHOESA-N
MW351.43 g/mol
LogP4.17
Rot. Bonds3

About (NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine

(NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine (PubChem CID 56665548) has the molecular formula C19H17N3O2S and a molecular weight of 351.43 g/mol. Its IUPAC name is (NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine
PubChem CID56665548
Molecular FormulaC19H17N3O2S
Molecular Weight351.43 g/mol
Exact Mass351.10
IUPAC Name(NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine
SMILESO/N=C(/c1cccnc1Oc1ccc2ccccc2c1)N1CCSC1
InChIInChI=1S/C19H17N3O2S/c23-21-18(22-10-11-25-13-22)17-6-3-9-20-19(17)24-16-8-7-14-4-1-2-5-15(14)12-16/h1-9,12,23H,10-11,13H2/b21-18-
InChIKeyZWHQZQVJPKQJNV-UZYVYHOESA-N
XLogP4.17
TPSA57.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.43
LogP ≤ 54.17
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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Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine (CID 56665548) is (NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine is O/N=C(/c1cccnc1Oc1ccc2ccccc2c1)N1CCSC1.
What is the InChIKey of (NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine?
The InChIKey is ZWHQZQVJPKQJNV-UZYVYHOESA-N. The full InChI is InChI=1S/C19H17N3O2S/c23-21-18(22-10-11-25-13-22)17-6-3-9-20-19(17)24-16-8-7-14-4-1-2-5-15(14)12-16/h1-9,12,23H,10-11,13H2/b21-18-.
What are the key properties of (NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine?
(NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine has a molecular weight of 351.43 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(2-naphthalen-2-yloxy-3-pyridinyl)-(1,3-thiazolidin-3-yl)methylidene]hydroxylamine is sourced from PubChem (CID 56665548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).