[1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine

C9H15BrN2OS — CID 105210144

IUPAC[1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine
SMILESCCCOCC(NN)c1sccc1Br
InChIInChI=1S/C9H15BrN2OS/c1-2-4-13-6-8(12-11)9-7(10)3-5-14-9/h3,5,8,12H,2,4,6,11H2,1H3
InChIKeyXXAWZWARNAJCCK-UHFFFAOYSA-N
MW279.20 g/mol
LogP2.44
Rot. Bonds6

About [1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine

[1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine (PubChem CID 105210144) has the molecular formula C9H15BrN2OS and a molecular weight of 279.20 g/mol. Its IUPAC name is [1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine
PubChem CID105210144
Molecular FormulaC9H15BrN2OS
Molecular Weight279.20 g/mol
Exact Mass278.01
IUPAC Name[1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine
SMILESCCCOCC(NN)c1sccc1Br
InChIInChI=1S/C9H15BrN2OS/c1-2-4-13-6-8(12-11)9-7(10)3-5-14-9/h3,5,8,12H,2,4,6,11H2,1H3
InChIKeyXXAWZWARNAJCCK-UHFFFAOYSA-N
XLogP2.44
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.20
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-methylthiophen-2-yl)-2-propoxyethyl]hydrazine
CID 105210038
[1-(3-bromothiophen-2-yl)-3-propoxypropan-2-yl]hydrazine
CID 105210102
1-(3-bromothiophen-2-yl)-3-propoxypropan-1-ol
CID 105119347
[1-(4-bromothiophen-2-yl)-2-propoxyethyl]hydrazine
CID 105222366
[1-(3-bromothiophen-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151632
1,2-bis(3-bromothiophen-2-yl)ethylhydrazine
CID 105299585
[1-(2-bromo-4-methylphenyl)-2-propoxyethyl]hydrazine
CID 105321406
[1-(1-benzothiophen-7-yl)-2-propoxyethyl]hydrazine
CID 105209936
[1-(3-bromothiophen-2-yl)-3,3,3-trifluoropropyl]hydrazine
CID 105206154
[1-(3-bromothiophen-2-yl)-2-tert-butylsulfanylethyl]hydrazine
CID 105226600
[1-(3-bromothiophen-2-yl)-2-(4-methoxyphenyl)ethyl]hydrazine
CID 105205541
1-(3-bromothiophen-2-yl)pent-4-ynylhydrazine
CID 105307933

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine?
The IUPAC name of [1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine (CID 105210144) is [1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine.
What is the SMILES notation for [1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine?
The canonical SMILES for [1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine is CCCOCC(NN)c1sccc1Br.
What is the InChIKey of [1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine?
The InChIKey is XXAWZWARNAJCCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15BrN2OS/c1-2-4-13-6-8(12-11)9-7(10)3-5-14-9/h3,5,8,12H,2,4,6,11H2,1H3.
What are the key properties of [1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine?
[1-(3-bromothiophen-2-yl)-2-propoxyethyl]hydrazine has a molecular weight of 279.20 g/mol, XLogP of 2.44, 6 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)-2-propoxyethyl]hydrazine is sourced from PubChem (CID 105210144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).