1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine

C15H27BrN2S — CID 105299478

IUPAC1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine
SMILESCCCCCCCCCC(Cc1sccc1Br)NN
InChIInChI=1S/C15H27BrN2S/c1-2-3-4-5-6-7-8-9-13(18-17)12-15-14(16)10-11-19-15/h10-11,13,18H,2-9,12,17H2,1H3
InChIKeyCJKKGFIGOWVURT-UHFFFAOYSA-N
MW347.37 g/mol
LogP5.03
Rot. Bonds11

About 1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine

1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine (PubChem CID 105299478) has the molecular formula C15H27BrN2S and a molecular weight of 347.37 g/mol. Its IUPAC name is 1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine.

Molecular Properties

Compound Name1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine
PubChem CID105299478
Molecular FormulaC15H27BrN2S
Molecular Weight347.37 g/mol
Exact Mass346.11
IUPAC Name1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine
SMILESCCCCCCCCCC(Cc1sccc1Br)NN
InChIInChI=1S/C15H27BrN2S/c1-2-3-4-5-6-7-8-9-13(18-17)12-15-14(16)10-11-19-15/h10-11,13,18H,2-9,12,17H2,1H3
InChIKeyCJKKGFIGOWVURT-UHFFFAOYSA-N
XLogP5.03
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.37
LogP ≤ 55.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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)decan-2-ylhydrazine
CID 105299600
[1-(3-bromothiophen-2-yl)-4-ethoxybutan-2-yl]hydrazine
CID 105299615
4-(3-bromothiophen-2-yl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 105259328
[1-(3-bromothiophen-2-yl)-5-methoxyhexan-2-yl]hydrazine
CID 105299566
[1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine
CID 105210102
1-(3-bromothiophen-2-yl)heptan-2-ol
CID 65149568
3-(3-bromothiophen-2-yl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105244859
[1-(3-bromothiophen-2-yl)-4-(2-methoxyethoxy)butan-2-yl]hydrazine
CID 102929781
1-(1,3-thiazol-2-yl)undecan-2-ylhydrazine
CID 105324540
1-(3-bromothiophen-2-yl)pent-4-en-2-ylhydrazine
CID 105269766
1-(5-ethylthiophen-2-yl)decan-2-ylhydrazine
CID 105296454
[1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine
CID 105212499

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine?
The IUPAC name of 1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine (CID 105299478) is 1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine.
What is the SMILES notation for 1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine?
The canonical SMILES for 1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine is CCCCCCCCCC(Cc1sccc1Br)NN.
What is the InChIKey of 1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine?
The InChIKey is CJKKGFIGOWVURT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27BrN2S/c1-2-3-4-5-6-7-8-9-13(18-17)12-15-14(16)10-11-19-15/h10-11,13,18H,2-9,12,17H2,1H3.
What are the key properties of 1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine?
1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine has a molecular weight of 347.37 g/mol, XLogP of 5.03, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromothiophen-2-yl)undecan-2-ylhydrazine is sourced from PubChem (CID 105299478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).