1,4-di(thiophen-3-yl)butan-2-ylhydrazine

C12H16N2S2 — CID 105306843

IUPAC1,4-di(thiophen-3-yl)butan-2-ylhydrazine
SMILESNNC(CCc1ccsc1)Cc1ccsc1
InChIInChI=1S/C12H16N2S2/c13-14-12(7-11-4-6-16-9-11)2-1-10-3-5-15-8-10/h3-6,8-9,12,14H,1-2,7,13H2
InChIKeyLRQCSMBQWBCPFC-UHFFFAOYSA-N
MW252.41 g/mol
LogP2.82
Rot. Bonds6

About 1,4-di(thiophen-3-yl)butan-2-ylhydrazine

1,4-di(thiophen-3-yl)butan-2-ylhydrazine (PubChem CID 105306843) has the molecular formula C12H16N2S2 and a molecular weight of 252.41 g/mol. Its IUPAC name is 1,4-di(thiophen-3-yl)butan-2-ylhydrazine.

Molecular Properties

Compound Name1,4-di(thiophen-3-yl)butan-2-ylhydrazine
PubChem CID105306843
Molecular FormulaC12H16N2S2
Molecular Weight252.41 g/mol
Exact Mass252.08
IUPAC Name1,4-di(thiophen-3-yl)butan-2-ylhydrazine
SMILESNNC(CCc1ccsc1)Cc1ccsc1
InChIInChI=1S/C12H16N2S2/c13-14-12(7-11-4-6-16-9-11)2-1-10-3-5-15-8-10/h3-6,8-9,12,14H,1-2,7,13H2
InChIKeyLRQCSMBQWBCPFC-UHFFFAOYSA-N
XLogP2.82
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.41
LogP ≤ 52.82
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'}

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Related Compounds

(4-phenyl-1-thiophen-3-ylbutan-2-yl)hydrazine
CID 105205761
[4-(1-methylpyrazol-4-yl)-1-thiophen-3-ylbutan-2-yl]hydrazine
CID 103025780
(6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine
CID 105249014
1-thiophen-3-ylbutan-2-ylhydrazine
CID 105201099
(1-pyridin-2-yl-5-thiophen-3-ylpentan-3-yl)hydrazine
CID 105306797
(1-cyclobutyl-3-thiophen-3-ylpropan-2-yl)hydrazine
CID 105310141
N-methyl-4-phenyl-1-thiophen-3-ylbutan-2-amine
CID 61078547
[1-(2,6-difluorophenyl)-3-thiophen-3-ylpropan-2-yl]hydrazine
CID 105297672
[1-(2,3-dihydro-1H-inden-5-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine
CID 105310746
(1-cyclohexylsulfanyl-3-thiophen-3-ylpropan-2-yl)hydrazine
CID 105227893
4-(4-methoxyphenyl)-N-methyl-1-thiophen-3-ylbutan-2-amine
CID 61078016
[1-(3-methylphenoxy)-5-thiophen-3-ylpentan-3-yl]hydrazine
CID 105306880

Frequently Asked Questions

What is the IUPAC name of 1,4-di(thiophen-3-yl)butan-2-ylhydrazine?
The IUPAC name of 1,4-di(thiophen-3-yl)butan-2-ylhydrazine (CID 105306843) is 1,4-di(thiophen-3-yl)butan-2-ylhydrazine.
What is the SMILES notation for 1,4-di(thiophen-3-yl)butan-2-ylhydrazine?
The canonical SMILES for 1,4-di(thiophen-3-yl)butan-2-ylhydrazine is NNC(CCc1ccsc1)Cc1ccsc1.
What is the InChIKey of 1,4-di(thiophen-3-yl)butan-2-ylhydrazine?
The InChIKey is LRQCSMBQWBCPFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2S2/c13-14-12(7-11-4-6-16-9-11)2-1-10-3-5-15-8-10/h3-6,8-9,12,14H,1-2,7,13H2.
What are the key properties of 1,4-di(thiophen-3-yl)butan-2-ylhydrazine?
1,4-di(thiophen-3-yl)butan-2-ylhydrazine has a molecular weight of 252.41 g/mol, XLogP of 2.82, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-di(thiophen-3-yl)butan-2-ylhydrazine is sourced from PubChem (CID 105306843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).