[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine

C11H21N3S2 — CID 105213765

IUPAC[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine
SMILESCSCC(Cc1nc(C(C)(C)C)cs1)NN
InChIInChI=1S/C11H21N3S2/c1-11(2,3)9-7-16-10(13-9)5-8(14-12)6-15-4/h7-8,14H,5-6,12H2,1-4H3
InChIKeyDNRDPYOQECDMRW-UHFFFAOYSA-N
MW259.44 g/mol
LogP2.18
Rot. Bonds5

About [1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine

[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine (PubChem CID 105213765) has the molecular formula C11H21N3S2 and a molecular weight of 259.44 g/mol. Its IUPAC name is [1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine
PubChem CID105213765
Molecular FormulaC11H21N3S2
Molecular Weight259.44 g/mol
Exact Mass259.12
IUPAC Name[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine
SMILESCSCC(Cc1nc(C(C)(C)C)cs1)NN
InChIInChI=1S/C11H21N3S2/c1-11(2,3)9-7-16-10(13-9)5-8(14-12)6-15-4/h7-8,14H,5-6,12H2,1-4H3
InChIKeyDNRDPYOQECDMRW-UHFFFAOYSA-N
XLogP2.18
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 52.18
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-(4-tert-butyl-1,3-thiazol-2-yl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
CID 105214128
[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-phenylpropan-2-yl]hydrazine
CID 105195130
[1-(4-tert-butyl-1,3-thiazol-2-yl)-4-ethoxybutan-2-yl]hydrazine
CID 105325005
[1-(4-tert-butyl-1,3-thiazol-2-yl)-4-pyridin-3-ylbutan-2-yl]hydrazine
CID 105324991
1-(4-tert-butyl-1,3-thiazol-2-yl)-3-cyclobutyl-N-propylpropan-2-amine
CID 103169196
[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(3,5-dibromophenyl)ethyl]hydrazine
CID 107979295
[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-thiophen-3-ylethyl]hydrazine
CID 105196695
1-(4-tert-butyl-1,3-thiazol-2-yl)-3-cycloheptyl-N-methylpropan-2-amine
CID 105015894
5-(4-tert-butyl-1,3-thiazol-2-yl)-4-methylpentan-2-amine
CID 79817319
1-(4-tert-butyl-1,3-thiazol-2-yl)-4-methylpentan-2-amine
CID 79820663
1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methoxypropan-2-amine
CID 79820516
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 [1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine?
The IUPAC name of [1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine (CID 105213765) is [1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine.
What is the SMILES notation for [1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine?
The canonical SMILES for [1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine is CSCC(Cc1nc(C(C)(C)C)cs1)NN.
What is the InChIKey of [1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine?
The InChIKey is DNRDPYOQECDMRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3S2/c1-11(2,3)9-7-16-10(13-9)5-8(14-12)6-15-4/h7-8,14H,5-6,12H2,1-4H3.
What are the key properties of [1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine?
[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine has a molecular weight of 259.44 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-tert-butyl-1,3-thiazol-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine is sourced from PubChem (CID 105213765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).