[2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine

C12H14BrN3S — CID 105299375

IUPAC[2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
SMILESCc1cncc(C(Cc2cc(Br)cs2)NN)c1
InChIInChI=1S/C12H14BrN3S/c1-8-2-9(6-15-5-8)12(16-14)4-11-3-10(13)7-17-11/h2-3,5-7,12,16H,4,14H2,1H3
InChIKeyXQKNMKWDAPUUEV-UHFFFAOYSA-N
MW312.24 g/mol
LogP2.96
Rot. Bonds4

About [2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine

[2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine (PubChem CID 105299375) has the molecular formula C12H14BrN3S and a molecular weight of 312.24 g/mol. Its IUPAC name is [2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
PubChem CID105299375
Molecular FormulaC12H14BrN3S
Molecular Weight312.24 g/mol
Exact Mass311.01
IUPAC Name[2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
SMILESCc1cncc(C(Cc2cc(Br)cs2)NN)c1
InChIInChI=1S/C12H14BrN3S/c1-8-2-9(6-15-5-8)12(16-14)4-11-3-10(13)7-17-11/h2-3,5-7,12,16H,4,14H2,1H3
InChIKeyXQKNMKWDAPUUEV-UHFFFAOYSA-N
XLogP2.96
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.24
LogP ≤ 52.96
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

N-[2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine
CID 105139385
[2-(4-bromothiophen-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105257514
[2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
CID 105261639
[2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
CID 105299200
[2-(3-bromo-5-fluorophenyl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
CID 105324860
2-(4-bromothiophen-2-yl)-1-(5-fluoro-3-pyridinyl)-N-methylethanamine
CID 105139329
[2-(4-bromothiophen-2-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]hydrazine
CID 105256508
2-hydrazinyl-N,N-dimethyl-2-(5-methyl-3-pyridinyl)ethanamine
CID 105244710
[2-(furan-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
CID 105331621
[2-(4-bromothiophen-2-yl)-1-(3-fluorophenyl)ethyl]hydrazine
CID 105193124
1-(4-bromothiophen-2-yl)butan-2-ylhydrazine
CID 105201113
1-(5-methyl-3-pyridinyl)pentylhydrazine
CID 105245659

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine (CID 105299375) is [2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine is Cc1cncc(C(Cc2cc(Br)cs2)NN)c1.
What is the InChIKey of [2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine?
The InChIKey is XQKNMKWDAPUUEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrN3S/c1-8-2-9(6-15-5-8)12(16-14)4-11-3-10(13)7-17-11/h2-3,5-7,12,16H,4,14H2,1H3.
What are the key properties of [2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine?
[2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine has a molecular weight of 312.24 g/mol, XLogP of 2.96, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105299375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).