[(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine

C14H16Br2N2OS — CID 107970581

IUPAC[(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine
SMILESCCCOc1ccccc1C(NN)c1cc(Br)sc1Br
InChIInChI=1S/C14H16Br2N2OS/c1-2-7-19-11-6-4-3-5-9(11)13(18-17)10-8-12(15)20-14(10)16/h3-6,8,13,18H,2,7,17H2,1H3
InChIKeyCRWRMAKPOJMTMO-UHFFFAOYSA-N
MW420.17 g/mol
LogP4.61
Rot. Bonds6

About [(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine

[(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine (PubChem CID 107970581) has the molecular formula C14H16Br2N2OS and a molecular weight of 420.17 g/mol. Its IUPAC name is [(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine
PubChem CID107970581
Molecular FormulaC14H16Br2N2OS
Molecular Weight420.17 g/mol
Exact Mass417.94
IUPAC Name[(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine
SMILESCCCOc1ccccc1C(NN)c1cc(Br)sc1Br
InChIInChI=1S/C14H16Br2N2OS/c1-2-7-19-11-6-4-3-5-9(11)13(18-17)10-8-12(15)20-14(10)16/h3-6,8,13,18H,2,7,17H2,1H3
InChIKeyCRWRMAKPOJMTMO-UHFFFAOYSA-N
XLogP4.61
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.17
LogP ≤ 54.61
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

[(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 107970496
[(5-bromo-4-methylthiophen-2-yl)-(2-propoxyphenyl)methyl]hydrazine
CID 105334423
[(5-methylthiophen-2-yl)-(2-propoxyphenyl)methyl]hydrazine
CID 105334353
(2,5-dibromothiophen-3-yl)-(2-ethoxyphenyl)methanamine
CID 43345009
[(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine
CID 107970229
(5-bromo-4-methylthiophen-2-yl)-(2-propoxyphenyl)methanamine
CID 105035965
[(3-chlorophenyl)-(2-propoxyphenyl)methyl]hydrazine
CID 105194583
[(3-methyl-4-pyridinyl)-(2-propoxyphenyl)methyl]hydrazine
CID 105261791
2,5-dibromo-3-[chloro-(2-ethoxyphenyl)methyl]thiophene
CID 55198913
[(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine
CID 107970220
[(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine
CID 105304440
[1H-imidazol-2-yl-(2-propoxyphenyl)methyl]hydrazine
CID 105252074

Frequently Asked Questions

What is the IUPAC name of [(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine?
The IUPAC name of [(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine (CID 107970581) is [(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine is CCCOc1ccccc1C(NN)c1cc(Br)sc1Br.
What is the InChIKey of [(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine?
The InChIKey is CRWRMAKPOJMTMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Br2N2OS/c1-2-7-19-11-6-4-3-5-9(11)13(18-17)10-8-12(15)20-14(10)16/h3-6,8,13,18H,2,7,17H2,1H3.
What are the key properties of [(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine?
[(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine has a molecular weight of 420.17 g/mol, XLogP of 4.61, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 107970581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).