[5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine

C14H13N3OS — CID 79764794

IUPAC[5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COc2cccc3ccccc23)s1
InChIInChI=1S/C14H13N3OS/c15-17-14-16-8-11(19-14)9-18-13-7-3-5-10-4-1-2-6-12(10)13/h1-8H,9,15H2,(H,16,17)
InChIKeyJNQMTOJILDWHIO-UHFFFAOYSA-N
MW271.35 g/mol
LogP3.16
Rot. Bonds4

About [5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine

[5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine (PubChem CID 79764794) has the molecular formula C14H13N3OS and a molecular weight of 271.35 g/mol. Its IUPAC name is [5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine
PubChem CID79764794
Molecular FormulaC14H13N3OS
Molecular Weight271.35 g/mol
Exact Mass271.08
IUPAC Name[5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COc2cccc3ccccc23)s1
InChIInChI=1S/C14H13N3OS/c15-17-14-16-8-11(19-14)9-18-13-7-3-5-10-4-1-2-6-12(10)13/h1-8H,9,15H2,(H,16,17)
InChIKeyJNQMTOJILDWHIO-UHFFFAOYSA-N
XLogP3.16
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.35
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 [5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine (CID 79764794) is [5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine is NNc1ncc(COc2cccc3ccccc23)s1.
What is the InChIKey of [5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine?
The InChIKey is JNQMTOJILDWHIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3OS/c15-17-14-16-8-11(19-14)9-18-13-7-3-5-10-4-1-2-6-12(10)13/h1-8H,9,15H2,(H,16,17).
What are the key properties of [5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine?
[5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine has a molecular weight of 271.35 g/mol, XLogP of 3.16, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79764794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).