[2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine

C11H13BrN4S — CID 105261639

IUPAC[2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
SMILESCc1cnc(C(Cc2cc(Br)cs2)NN)nc1
InChIInChI=1S/C11H13BrN4S/c1-7-4-14-11(15-5-7)10(16-13)3-9-2-8(12)6-17-9/h2,4-6,10,16H,3,13H2,1H3
InChIKeySHKVHFVVKDMDRS-UHFFFAOYSA-N
MW313.22 g/mol
LogP2.36
Rot. Bonds4

About [2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine

[2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine (PubChem CID 105261639) has the molecular formula C11H13BrN4S and a molecular weight of 313.22 g/mol. Its IUPAC name is [2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
PubChem CID105261639
Molecular FormulaC11H13BrN4S
Molecular Weight313.22 g/mol
Exact Mass312.00
IUPAC Name[2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
SMILESCc1cnc(C(Cc2cc(Br)cs2)NN)nc1
InChIInChI=1S/C11H13BrN4S/c1-7-4-14-11(15-5-7)10(16-13)3-9-2-8(12)6-17-9/h2,4-6,10,16H,3,13H2,1H3
InChIKeySHKVHFVVKDMDRS-UHFFFAOYSA-N
XLogP2.36
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.22
LogP ≤ 52.36
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

[2-(4-bromothiophen-2-yl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
CID 105299375
[2-(4-bromothiophen-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105257514
[2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
CID 105299200
1-(4-bromothiophen-2-yl)butan-2-ylhydrazine
CID 105201113
4-[2-(4-bromothiophen-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
CID 105231274
[2-(5-bromo-2-methoxyphenyl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
CID 105261563
[2-(4-bromothiophen-2-yl)-1-(2-ethyl-5-methylpyrazol-3-yl)ethyl]hydrazine
CID 105299342
1-(5-methylpyrimidin-2-yl)propylhydrazine
CID 105261553
[2-(4-bromothiophen-2-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]hydrazine
CID 105256508
[2-(2-bromo-5-fluorophenyl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
CID 105261623
[2-(4-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine
CID 105299424
4-bromo-2-[2-(4-bromothiophen-2-yl)-1-hydrazinylethyl]aniline
CID 105263590

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine (CID 105261639) is [2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine is Cc1cnc(C(Cc2cc(Br)cs2)NN)nc1.
What is the InChIKey of [2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine?
The InChIKey is SHKVHFVVKDMDRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN4S/c1-7-4-14-11(15-5-7)10(16-13)3-9-2-8(12)6-17-9/h2,4-6,10,16H,3,13H2,1H3.
What are the key properties of [2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine?
[2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine has a molecular weight of 313.22 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromothiophen-2-yl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105261639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).