1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine

C18H18N2S — CID 169385414

IUPAC1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine
SMILESCc1ccc(-c2ccccc2CNNc2ccccc2)s1
InChIInChI=1S/C18H18N2S/c1-14-11-12-18(21-14)17-10-6-5-7-15(17)13-19-20-16-8-3-2-4-9-16/h2-12,19-20H,13H2,1H3
InChIKeyXUWHKSXJHZWZNJ-UHFFFAOYSA-N
MW294.42 g/mol
LogP4.84
Rot. Bonds5

About 1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine

1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine (PubChem CID 169385414) has the molecular formula C18H18N2S and a molecular weight of 294.42 g/mol. Its IUPAC name is 1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine
PubChem CID169385414
Molecular FormulaC18H18N2S
Molecular Weight294.42 g/mol
Exact Mass294.12
IUPAC Name1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine
SMILESCc1ccc(-c2ccccc2CNNc2ccccc2)s1
InChIInChI=1S/C18H18N2S/c1-14-11-12-18(21-14)17-10-6-5-7-15(17)13-19-20-16-8-3-2-4-9-16/h2-12,19-20H,13H2,1H3
InChIKeyXUWHKSXJHZWZNJ-UHFFFAOYSA-N
XLogP4.84
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine?
The IUPAC name of 1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine (CID 169385414) is 1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine is Cc1ccc(-c2ccccc2CNNc2ccccc2)s1.
What is the InChIKey of 1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine?
The InChIKey is XUWHKSXJHZWZNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2S/c1-14-11-12-18(21-14)17-10-6-5-7-15(17)13-19-20-16-8-3-2-4-9-16/h2-12,19-20H,13H2,1H3.
What are the key properties of 1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine?
1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine has a molecular weight of 294.42 g/mol, XLogP of 4.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(5-methylthiophen-2-yl)phenyl]methyl]-2-phenylhydrazine is sourced from PubChem (CID 169385414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).