[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide

C11H14BrN3OS — CID 171114823

IUPAC[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide
SMILESBr.CCOc1ccc(-c2csc(NN)n2)cc1
InChIInChI=1S/C11H13N3OS.BrH/c1-2-15-9-5-3-8(4-6-9)10-7-16-11(13-10)14-12;/h3-7H,2,12H2,1H3,(H,13,14);1H
InChIKeySUFDHKVBZYXYFZ-UHFFFAOYSA-N
MW316.22 g/mol
LogP3.07
Rot. Bonds4

About [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide

[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide (PubChem CID 171114823) has the molecular formula C11H14BrN3OS and a molecular weight of 316.22 g/mol. Its IUPAC name is [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide.

Molecular Properties

Compound Name[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide
PubChem CID171114823
Molecular FormulaC11H14BrN3OS
Molecular Weight316.22 g/mol
Exact Mass315.00
IUPAC Name[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide
SMILESBr.CCOc1ccc(-c2csc(NN)n2)cc1
InChIInChI=1S/C11H13N3OS.BrH/c1-2-15-9-5-3-8(4-6-9)10-7-16-11(13-10)14-12;/h3-7H,2,12H2,1H3,(H,13,14);1H
InChIKeySUFDHKVBZYXYFZ-UHFFFAOYSA-N
XLogP3.07
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.22
LogP ≤ 53.07
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

[4-[4-(2-methoxyethoxy)phenyl]-1,3-thiazol-2-yl]hydrazine
CID 95471163
[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]hydrazine
CID 5211248
4-(4-aminophenyl)-N-(4-ethoxyphenyl)-1,3-thiazol-2-amine
CID 13155729
4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 29457657
N-[[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]methyl]ethanamine;hydrochloride
CID 120558378
N-(4-ethoxyphenyl)-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-amine
CID 23889663
N,N-diethyl-4-(2-hydrazinyl-1,3-thiazol-4-yl)aniline
CID 7148397
N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119711324
4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole
CID 116967744
[4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine
CID 93188542
2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]ethanamine
CID 1497789
N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-4-phenoxybutanamide
CID 19173206

Frequently Asked Questions

What is the IUPAC name of [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide?
The IUPAC name of [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide (CID 171114823) is [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide.
What is the SMILES notation for [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide?
The canonical SMILES for [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide is Br.CCOc1ccc(-c2csc(NN)n2)cc1.
What is the InChIKey of [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide?
The InChIKey is SUFDHKVBZYXYFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3OS.BrH/c1-2-15-9-5-3-8(4-6-9)10-7-16-11(13-10)14-12;/h3-7H,2,12H2,1H3,(H,13,14);1H.
What are the key properties of [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide?
[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide has a molecular weight of 316.22 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide is sourced from PubChem (CID 171114823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).