[2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine

C14H16N4OS — CID 105332622

IUPAC[2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine
SMILESCOc1nccnc1C(NN)C1Cc2ccccc2S1
InChIInChI=1S/C14H16N4OS/c1-19-14-13(16-6-7-17-14)12(18-15)11-8-9-4-2-3-5-10(9)20-11/h2-7,11-12,18H,8,15H2,1H3
InChIKeyXKXDFYCEYYVAKZ-UHFFFAOYSA-N
MW288.38 g/mol
LogP1.71
Rot. Bonds4

About [2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine

[2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine (PubChem CID 105332622) has the molecular formula C14H16N4OS and a molecular weight of 288.38 g/mol. Its IUPAC name is [2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine
PubChem CID105332622
Molecular FormulaC14H16N4OS
Molecular Weight288.38 g/mol
Exact Mass288.10
IUPAC Name[2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine
SMILESCOc1nccnc1C(NN)C1Cc2ccccc2S1
InChIInChI=1S/C14H16N4OS/c1-19-14-13(16-6-7-17-14)12(18-15)11-8-9-4-2-3-5-10(9)20-11/h2-7,11-12,18H,8,15H2,1H3
InChIKeyXKXDFYCEYYVAKZ-UHFFFAOYSA-N
XLogP1.71
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.38
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

[2,3-dihydro-1-benzothiophen-2-yl(pyridin-3-yl)methyl]hydrazine
CID 105287045
[2,3-dihydro-1-benzothiophen-2-yl-(1-ethyl-4-methoxypyrazol-5-yl)methyl]hydrazine
CID 105339391
[1-(2,3-dihydro-1-benzothiophen-2-yl)-2-methoxyethyl]hydrazine
CID 105321616
[2,3-dihydro-1-benzothiophen-2-yl-(1,4-dimethylpyrazol-5-yl)methyl]hydrazine
CID 112742896
1-(2,3-dihydro-1-benzofuran-2-yl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 104516055
[(3-methoxypyrazin-2-yl)-(3-methylcyclopentyl)methyl]hydrazine
CID 105233232
[1-(2,3-dihydro-1-benzothiophen-2-yl)-2-pyridin-4-ylethyl]hydrazine
CID 105317497
[cyclohepten-1-yl(2,3-dihydro-1-benzothiophen-2-yl)methyl]hydrazine
CID 106650324
[(3-methoxypyrazin-2-yl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 105332713
[(3-methoxypyrazin-2-yl)-(oxolan-3-yl)methyl]hydrazine
CID 105229413
1-(2,3-dihydro-1-benzothiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine
CID 105149675
[2-(3-chloro-4-pyridinyl)-1-(2,3-dihydro-1-benzothiophen-2-yl)ethyl]hydrazine
CID 105314735

Frequently Asked Questions

What is the IUPAC name of [2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine?
The IUPAC name of [2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine (CID 105332622) is [2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine.
What is the SMILES notation for [2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine?
The canonical SMILES for [2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine is COc1nccnc1C(NN)C1Cc2ccccc2S1.
What is the InChIKey of [2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine?
The InChIKey is XKXDFYCEYYVAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4OS/c1-19-14-13(16-6-7-17-14)12(18-15)11-8-9-4-2-3-5-10(9)20-11/h2-7,11-12,18H,8,15H2,1H3.
What are the key properties of [2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine?
[2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine has a molecular weight of 288.38 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-dihydro-1-benzothiophen-2-yl-(3-methoxypyrazin-2-yl)methyl]hydrazine is sourced from PubChem (CID 105332622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).