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

C14H16Br2N2OS — CID 107970496

IUPAC[(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
SMILESCC(C)Oc1ccccc1C(NN)c1cc(Br)sc1Br
InChIInChI=1S/C14H16Br2N2OS/c1-8(2)19-11-6-4-3-5-9(11)13(18-17)10-7-12(15)20-14(10)16/h3-8,13,18H,17H2,1-2H3
InChIKeyGHJNVWPDBSJGSM-UHFFFAOYSA-N
MW420.17 g/mol
LogP4.61
Rot. Bonds5

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

[(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine (PubChem CID 107970496) has the molecular formula C14H16Br2N2OS and a molecular weight of 420.17 g/mol. Its IUPAC name is [(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
PubChem CID107970496
Molecular FormulaC14H16Br2N2OS
Molecular Weight420.17 g/mol
Exact Mass417.94
IUPAC Name[(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
SMILESCC(C)Oc1ccccc1C(NN)c1cc(Br)sc1Br
InChIInChI=1S/C14H16Br2N2OS/c1-8(2)19-11-6-4-3-5-9(11)13(18-17)10-7-12(15)20-14(10)16/h3-8,13,18H,17H2,1-2H3
InChIKeyGHJNVWPDBSJGSM-UHFFFAOYSA-N
XLogP4.61
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
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-propoxyphenyl)methyl]hydrazine
CID 107970581
[(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326074
[(2-bromo-4-chlorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 107997211
[(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine
CID 107970229
[(2-fluorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105216890
[(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine
CID 107970220
[(2,3-dichlorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326117
[(2,5-dimethylfuran-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326122
[(4-bromo-3-fluorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326153
[(4-fluorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105192765
[(2,5-dibromothiophen-3-yl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 107970684
(2,5-dibromothiophen-3-yl)-[2-(difluoromethoxy)phenyl]methanamine
CID 43345041

Frequently Asked Questions

What is the IUPAC name of [(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine?
The IUPAC name of [(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine (CID 107970496) is [(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine?
The canonical SMILES for [(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine is CC(C)Oc1ccccc1C(NN)c1cc(Br)sc1Br.
What is the InChIKey of [(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine?
The InChIKey is GHJNVWPDBSJGSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Br2N2OS/c1-8(2)19-11-6-4-3-5-9(11)13(18-17)10-7-12(15)20-14(10)16/h3-8,13,18H,17H2,1-2H3.
What are the key properties of [(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine?
[(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine has a molecular weight of 420.17 g/mol, XLogP of 4.61, 5 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-propan-2-yloxyphenyl)methyl]hydrazine is sourced from PubChem (CID 107970496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).