[4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine

C14H19N3S — CID 105332141

IUPAC[4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine
SMILESCc1cccc(CCC(Cc2cncs2)NN)c1
InChIInChI=1S/C14H19N3S/c1-11-3-2-4-12(7-11)5-6-13(17-15)8-14-9-16-10-18-14/h2-4,7,9-10,13,17H,5-6,8,15H2,1H3
InChIKeyWLTLSQOJJIDBLU-UHFFFAOYSA-N
MW261.39 g/mol
LogP2.46
Rot. Bonds6

About [4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine

[4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine (PubChem CID 105332141) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is [4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine
PubChem CID105332141
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC Name[4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine
SMILESCc1cccc(CCC(Cc2cncs2)NN)c1
InChIInChI=1S/C14H19N3S/c1-11-3-2-4-12(7-11)5-6-13(17-15)8-14-9-16-10-18-14/h2-4,7,9-10,13,17H,5-6,8,15H2,1H3
InChIKeyWLTLSQOJJIDBLU-UHFFFAOYSA-N
XLogP2.46
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 52.46
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-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-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

[4-phenyl-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine
CID 105205632
1-(3-methylphenyl)-3-(1,3-thiazol-5-yl)propan-2-amine
CID 112642897
[1-(3-methylphenyl)-5-phenylpentan-3-yl]hydrazine
CID 105285956
[1-(furan-3-yl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105331898
[1-(5-ethyl-2-pyridinyl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105324467
[1-(3,5-difluorophenyl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105413124
[1-(5-bromo-2-pyridinyl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105334652
[4-(furan-2-yl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine
CID 105331967
5-[2-(bromomethyl)-3-(3-methylphenyl)propyl]-1,3-thiazole
CID 112645336
[1-(2,3-difluorophenyl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105298035
[1-(3-methylphenyl)-5-(1-methylpyrazol-4-yl)pentan-3-yl]hydrazine
CID 103025657
[6,6-dimethyl-1-(3-methylphenyl)heptan-3-yl]hydrazine
CID 105300120

Frequently Asked Questions

What is the IUPAC name of [4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine?
The IUPAC name of [4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine (CID 105332141) is [4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine.
What is the SMILES notation for [4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine?
The canonical SMILES for [4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine is Cc1cccc(CCC(Cc2cncs2)NN)c1.
What is the InChIKey of [4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine?
The InChIKey is WLTLSQOJJIDBLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c1-11-3-2-4-12(7-11)5-6-13(17-15)8-14-9-16-10-18-14/h2-4,7,9-10,13,17H,5-6,8,15H2,1H3.
What are the key properties of [4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine?
[4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine has a molecular weight of 261.39 g/mol, XLogP of 2.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-methylphenyl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine is sourced from PubChem (CID 105332141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).