[2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine

C16H15BrN2S — CID 105213280

IUPAC[2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine
SMILESNNC(Cc1cc(Br)cs1)c1cccc2ccccc12
InChIInChI=1S/C16H15BrN2S/c17-12-8-13(20-10-12)9-16(19-18)15-7-3-5-11-4-1-2-6-14(11)15/h1-8,10,16,19H,9,18H2
InChIKeyDQYRICZTJMTVHT-UHFFFAOYSA-N
MW347.28 g/mol
LogP4.41
Rot. Bonds4

About [2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine

[2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine (PubChem CID 105213280) has the molecular formula C16H15BrN2S and a molecular weight of 347.28 g/mol. Its IUPAC name is [2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine
PubChem CID105213280
Molecular FormulaC16H15BrN2S
Molecular Weight347.28 g/mol
Exact Mass346.01
IUPAC Name[2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine
SMILESNNC(Cc1cc(Br)cs1)c1cccc2ccccc12
InChIInChI=1S/C16H15BrN2S/c17-12-8-13(20-10-12)9-16(19-18)15-7-3-5-11-4-1-2-6-14(11)15/h1-8,10,16,19H,9,18H2
InChIKeyDQYRICZTJMTVHT-UHFFFAOYSA-N
XLogP4.41
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.28
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[1-(3-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine
CID 105299354
[2-(4-bromothiophen-2-yl)-1-(2-methoxyphenyl)ethyl]hydrazine
CID 105191242
4-bromo-2-[2-(4-bromothiophen-2-yl)-1-hydrazinylethyl]aniline
CID 105263590
[1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine
CID 105299240
[2-(4-bromothiophen-2-yl)-1-(3-fluorophenyl)ethyl]hydrazine
CID 105193124
1-(4-bromothiophen-2-yl)-3-naphthalen-1-ylpropan-2-amine
CID 105139176
[2-(4-bromothiophen-2-yl)-1-[4-bromo-2-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105212857
2-[2-(4-bromothiophen-2-yl)-1-hydrazinylethyl]-4-(trifluoromethyl)aniline
CID 105264927
4-[2-(4-bromothiophen-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
CID 105231274
2-(4-bromothiophen-2-yl)-1-(2,3-dimethoxyphenyl)-N-ethylethanamine
CID 105139259
[2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine
CID 105299378
[2-(4-bromothiophen-2-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252540

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine?
The IUPAC name of [2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine (CID 105213280) is [2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine.
What is the SMILES notation for [2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine?
The canonical SMILES for [2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine is NNC(Cc1cc(Br)cs1)c1cccc2ccccc12.
What is the InChIKey of [2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine?
The InChIKey is DQYRICZTJMTVHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrN2S/c17-12-8-13(20-10-12)9-16(19-18)15-7-3-5-11-4-1-2-6-14(11)15/h1-8,10,16,19H,9,18H2.
What are the key properties of [2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine?
[2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine has a molecular weight of 347.28 g/mol, XLogP of 4.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromothiophen-2-yl)-1-naphthalen-1-ylethyl]hydrazine is sourced from PubChem (CID 105213280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).