[5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine

C16H17N3OS — CID 94775107

IUPAC[5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine
SMILESCCOc1ccc2ccccc2c1-c1sc(NN)nc1C
InChIInChI=1S/C16H17N3OS/c1-3-20-13-9-8-11-6-4-5-7-12(11)14(13)15-10(2)18-16(19-17)21-15/h4-9H,3,17H2,1-2H3,(H,18,19)
InChIKeyAXSHCLDTFQJJCL-UHFFFAOYSA-N
MW299.40 g/mol
LogP3.96
Rot. Bonds4

About [5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine

[5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine (PubChem CID 94775107) has the molecular formula C16H17N3OS and a molecular weight of 299.40 g/mol. Its IUPAC name is [5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine
PubChem CID94775107
Molecular FormulaC16H17N3OS
Molecular Weight299.40 g/mol
Exact Mass299.11
IUPAC Name[5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine
SMILESCCOc1ccc2ccccc2c1-c1sc(NN)nc1C
InChIInChI=1S/C16H17N3OS/c1-3-20-13-9-8-11-6-4-5-7-12(11)14(13)15-10(2)18-16(19-17)21-15/h4-9H,3,17H2,1-2H3,(H,18,19)
InChIKeyAXSHCLDTFQJJCL-UHFFFAOYSA-N
XLogP3.96
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 53.96
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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Related Compounds

[5-(3-ethoxy-4-propoxyphenyl)-4-methyl-1,3-thiazol-2-yl]hydrazine
CID 94775313
5-(2-methoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-amine
CID 82161128
5-(chloromethyl)-3-(2-ethoxynaphthalen-1-yl)-1,2,4-oxadiazole
CID 54847485
(2-ethoxynaphthalen-1-yl)-dimethylborane
CID 67978534
[5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine
CID 79764794
[5-(2-ethoxyphenyl)-4-methyl-1,3-thiazol-2-yl]methanamine
CID 39351015
2-amino-N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-4-methyl-1,3-thiazole-5-carboxamide
CID 7240387
trimethyl-[1-(2-trimethylsilyloxynaphthalen-1-yl)naphthalen-2-yl]oxysilane
CID 53486788
2-ethoxy-1-[2-ethoxy-6-[6-ethoxy-5-(2-ethoxynaphthalen-1-yl)naphthalen-2-yl]naphthalen-1-yl]-6-iodonaphthalene
CID 10974840
[3-(2-methoxynaphthalen-1-yl)pyrazin-2-yl]hydrazine
CID 115914380
1-(2-ethoxynaphthalen-1-yl)propan-1-amine
CID 82263032
(1S)-1-(2-ethoxynaphthalen-1-yl)propan-1-amine
CID 95420558

Frequently Asked Questions

What is the IUPAC name of [5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine (CID 94775107) is [5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine is CCOc1ccc2ccccc2c1-c1sc(NN)nc1C.
What is the InChIKey of [5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine?
The InChIKey is AXSHCLDTFQJJCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3OS/c1-3-20-13-9-8-11-6-4-5-7-12(11)14(13)15-10(2)18-16(19-17)21-15/h4-9H,3,17H2,1-2H3,(H,18,19).
What are the key properties of [5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine?
[5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine has a molecular weight of 299.40 g/mol, XLogP of 3.96, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-ethoxynaphthalen-1-yl)-4-methyl-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 94775107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).