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

C9H14F3N3OS — CID 103151746

IUPAC[1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
SMILESNNC(CCOCC(F)(F)F)Cc1cncs1
InChIInChI=1S/C9H14F3N3OS/c10-9(11,12)5-16-2-1-7(15-13)3-8-4-14-6-17-8/h4,6-7,15H,1-3,5,13H2
InChIKeyIYIPSUDQHJEQOV-UHFFFAOYSA-N
MW269.29 g/mol
LogP1.49
Rot. Bonds7

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

[1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine (PubChem CID 103151746) has the molecular formula C9H14F3N3OS and a molecular weight of 269.29 g/mol. Its IUPAC name is [1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
PubChem CID103151746
Molecular FormulaC9H14F3N3OS
Molecular Weight269.29 g/mol
Exact Mass269.08
IUPAC Name[1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
SMILESNNC(CCOCC(F)(F)F)Cc1cncs1
InChIInChI=1S/C9H14F3N3OS/c10-9(11,12)5-16-2-1-7(15-13)3-8-4-14-6-17-8/h4,6-7,15H,1-3,5,13H2
InChIKeyIYIPSUDQHJEQOV-UHFFFAOYSA-N
XLogP1.49
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.29
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze [1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)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

[1-(3,5-difluorophenyl)-3-(1,3-thiazol-5-yl)propan-2-yl]hydrazine
CID 105206643
[1-cyclopropyl-3-(1,3-thiazol-5-yl)propan-2-yl]hydrazine
CID 105254030
1-(2,2,2-trifluoroethoxy)pentan-3-ylhydrazine
CID 103151464
[4-phenyl-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine
CID 105205632
[1-(1-methyltriazol-4-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 107066481
[1-propan-2-yloxy-3-(1,3-thiazol-5-yl)propan-2-yl]hydrazine
CID 105331931
[1-(4-bromophenyl)-3-(1,3-thiazol-5-yl)propan-2-yl]hydrazine
CID 105195489
[7,7,7-trifluoro-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151566
[1-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151667
[1-(2-chloro-6-fluorophenyl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151588
4-(2-methoxyethoxy)-1-(1,3-thiazol-5-yl)butan-2-amine
CID 102927931
[4-(furan-2-yl)-1-(1,3-thiazol-5-yl)butan-2-yl]hydrazine
CID 105331967

Frequently Asked Questions

What is the IUPAC name of [1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine?
The IUPAC name of [1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine (CID 103151746) is [1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine.
What is the SMILES notation for [1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine?
The canonical SMILES for [1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine is NNC(CCOCC(F)(F)F)Cc1cncs1.
What is the InChIKey of [1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine?
The InChIKey is IYIPSUDQHJEQOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F3N3OS/c10-9(11,12)5-16-2-1-7(15-13)3-8-4-14-6-17-8/h4,6-7,15H,1-3,5,13H2.
What are the key properties of [1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine?
[1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine has a molecular weight of 269.29 g/mol, XLogP of 1.49, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine is sourced from PubChem (CID 103151746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).