[4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine

C13H17N3S — CID 93188542

IUPAC[4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine
SMILESCCCCc1ccc(-c2csc(NN)n2)cc1
InChIInChI=1S/C13H17N3S/c1-2-3-4-10-5-7-11(8-6-10)12-9-17-13(15-12)16-14/h5-9H,2-4,14H2,1H3,(H,15,16)
InChIKeyQENYUSYOLHFFFI-UHFFFAOYSA-N
MW247.37 g/mol
LogP3.44
Rot. Bonds5

About [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine

[4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine (PubChem CID 93188542) has the molecular formula C13H17N3S and a molecular weight of 247.37 g/mol. Its IUPAC name is [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine
PubChem CID93188542
Molecular FormulaC13H17N3S
Molecular Weight247.37 g/mol
Exact Mass247.11
IUPAC Name[4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine
SMILESCCCCc1ccc(-c2csc(NN)n2)cc1
InChIInChI=1S/C13H17N3S/c1-2-3-4-10-5-7-11(8-6-10)12-9-17-13(15-12)16-14/h5-9H,2-4,14H2,1H3,(H,15,16)
InChIKeyQENYUSYOLHFFFI-UHFFFAOYSA-N
XLogP3.44
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.37
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-diethyl-4-(2-hydrazinyl-1,3-thiazol-4-yl)aniline
CID 7148397
[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide
CID 171114823
[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]hydrazine
CID 5211248
(2R)-2-chloro-N-[4-(4-hexylphenyl)-1,3-thiazol-2-yl]propanamide
CID 2369609
2-[4-(4-butylphenyl)-1,3-thiazol-2-yl]acetonitrile
CID 95464853
[4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride
CID 90481496
N-[4-(4-butylphenyl)-1,3-thiazol-2-yl]-4-hydroxypyrrolidine-2-carboxamide
CID 119686515
N-[4-(4-butylphenyl)-1,3-thiazol-2-yl]-4-methoxypiperidine-4-carboxamide
CID 119686519
4-[4-(4-propylphenyl)-1,3-thiazol-2-yl]aniline
CID 43667849
4-(3,4-difluorophenyl)-N-(4-pentylphenyl)-1,3-thiazol-2-amine
CID 58791311
2-[1-[2-[[4-(4-butylphenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]cyclopentyl]acetic acid
CID 17349285
N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]hexanamide
CID 55382237

Frequently Asked Questions

What is the IUPAC name of [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine (CID 93188542) is [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine is CCCCc1ccc(-c2csc(NN)n2)cc1.
What is the InChIKey of [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine?
The InChIKey is QENYUSYOLHFFFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3S/c1-2-3-4-10-5-7-11(8-6-10)12-9-17-13(15-12)16-14/h5-9H,2-4,14H2,1H3,(H,15,16).
What are the key properties of [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine?
[4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine has a molecular weight of 247.37 g/mol, XLogP of 3.44, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 93188542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).