[1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine

C12H14BrN3S — CID 105327947

IUPAC[1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine
SMILESNNC(CCc1ccncc1)c1sccc1Br
InChIInChI=1S/C12H14BrN3S/c13-10-5-8-17-12(10)11(16-14)2-1-9-3-6-15-7-4-9/h3-8,11,16H,1-2,14H2
InChIKeyBYPCWXRQKKEJCI-UHFFFAOYSA-N
MW312.24 g/mol
LogP3.04
Rot. Bonds5

About [1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine

[1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine (PubChem CID 105327947) has the molecular formula C12H14BrN3S and a molecular weight of 312.24 g/mol. Its IUPAC name is [1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine
PubChem CID105327947
Molecular FormulaC12H14BrN3S
Molecular Weight312.24 g/mol
Exact Mass311.01
IUPAC Name[1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine
SMILESNNC(CCc1ccncc1)c1sccc1Br
InChIInChI=1S/C12H14BrN3S/c13-10-5-8-17-12(10)11(16-14)2-1-9-3-6-15-7-4-9/h3-8,11,16H,1-2,14H2
InChIKeyBYPCWXRQKKEJCI-UHFFFAOYSA-N
XLogP3.04
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.24
LogP ≤ 53.04
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

[1-(3-bromothiophen-2-yl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105310605
1-(3-bromothiophen-2-yl)pent-4-ynylhydrazine
CID 105307933
1,2-bis(3-bromothiophen-2-yl)ethylhydrazine
CID 105299585
4-[2-(3-bromothiophen-2-yl)-2-chloroethyl]pyridine
CID 66460593
[1-(3-bromothiophen-2-yl)-2-thiophen-3-ylethyl]hydrazine
CID 105297810
[1-(3-bromothiophen-2-yl)-3-cyclohexylpropyl]hydrazine
CID 105327876
[1-(3-bromothiophen-2-yl)-3,3,3-trifluoropropyl]hydrazine
CID 105206154
1-(3-bromothiophen-2-yl)-N-(pyridin-4-ylmethyl)ethanamine
CID 43769411
[1-(3-bromothiophen-2-yl)-2-(4-methoxyphenyl)ethyl]hydrazine
CID 105205541
1-(3-bromothiophen-2-yl)-N-propyl-3-pyridin-3-ylpropan-1-amine
CID 105173119
[1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine
CID 105212499
[1-(3-bromothiophen-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151632

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine?
The IUPAC name of [1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine (CID 105327947) is [1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine.
What is the SMILES notation for [1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine?
The canonical SMILES for [1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine is NNC(CCc1ccncc1)c1sccc1Br.
What is the InChIKey of [1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine?
The InChIKey is BYPCWXRQKKEJCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrN3S/c13-10-5-8-17-12(10)11(16-14)2-1-9-3-6-15-7-4-9/h3-8,11,16H,1-2,14H2.
What are the key properties of [1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine?
[1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine has a molecular weight of 312.24 g/mol, XLogP of 3.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine is sourced from PubChem (CID 105327947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).