[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine

C16H23N3S2 — CID 105324951

IUPAC[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
SMILESCC(C)(C)c1csc(CC(NN)c2cc3c(s2)CCC3)n1
InChIInChI=1S/C16H23N3S2/c1-16(2,3)14-9-20-15(18-14)8-11(19-17)13-7-10-5-4-6-12(10)21-13/h7,9,11,19H,4-6,8,17H2,1-3H3
InChIKeyMLYDEMDIIZJONF-UHFFFAOYSA-N
MW321.52 g/mol
LogP3.74
Rot. Bonds4

About [2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine

[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine (PubChem CID 105324951) has the molecular formula C16H23N3S2 and a molecular weight of 321.52 g/mol. Its IUPAC name is [2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
PubChem CID105324951
Molecular FormulaC16H23N3S2
Molecular Weight321.52 g/mol
Exact Mass321.13
IUPAC Name[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
SMILESCC(C)(C)c1csc(CC(NN)c2cc3c(s2)CCC3)n1
InChIInChI=1S/C16H23N3S2/c1-16(2,3)14-9-20-15(18-14)8-11(19-17)13-7-10-5-4-6-12(10)21-13/h7,9,11,19H,4-6,8,17H2,1-3H3
InChIKeyMLYDEMDIIZJONF-UHFFFAOYSA-N
XLogP3.74
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.52
LogP ≤ 53.74
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

[1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4,4-dimethylpentyl]hydrazine
CID 105299986
[2-(3,5-difluorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
CID 105413104
[1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4-methoxy-4-methylpentyl]hydrazine
CID 103026377
[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-thiophen-3-ylethyl]hydrazine
CID 105196695
[2-(2,5-dimethylphenyl)-1-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethyl]hydrazine
CID 105287656
[3-ethyl-1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentyl]hydrazine
CID 105330949
1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 105014840
[2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
CID 105293121
1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)undecylhydrazine
CID 105298347
[2-(4-chlorophenyl)-1-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethyl]hydrazine
CID 105283232
[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(2-chlorophenyl)ethyl]hydrazine
CID 105210972
4-bromo-2-[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-hydrazinylethyl]aniline
CID 105263391

Frequently Asked Questions

What is the IUPAC name of [2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine (CID 105324951) is [2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine is CC(C)(C)c1csc(CC(NN)c2cc3c(s2)CCC3)n1.
What is the InChIKey of [2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
The InChIKey is MLYDEMDIIZJONF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3S2/c1-16(2,3)14-9-20-15(18-14)8-11(19-17)13-7-10-5-4-6-12(10)21-13/h7,9,11,19H,4-6,8,17H2,1-3H3.
What are the key properties of [2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine has a molecular weight of 321.52 g/mol, XLogP of 3.74, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105324951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).