[(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine

C13H16N2O2S — CID 105196872

IUPAC[(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine
SMILESCOc1ccc(OC)c(C(NN)c2ccsc2)c1
InChIInChI=1S/C13H16N2O2S/c1-16-10-3-4-12(17-2)11(7-10)13(15-14)9-5-6-18-8-9/h3-8,13,15H,14H2,1-2H3
InChIKeyKBKUWUZWNJKBLC-UHFFFAOYSA-N
MW264.35 g/mol
LogP2.32
Rot. Bonds5

About [(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine

[(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine (PubChem CID 105196872) has the molecular formula C13H16N2O2S and a molecular weight of 264.35 g/mol. Its IUPAC name is [(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine
PubChem CID105196872
Molecular FormulaC13H16N2O2S
Molecular Weight264.35 g/mol
Exact Mass264.09
IUPAC Name[(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine
SMILESCOc1ccc(OC)c(C(NN)c2ccsc2)c1
InChIInChI=1S/C13H16N2O2S/c1-16-10-3-4-12(17-2)11(7-10)13(15-14)9-5-6-18-8-9/h3-8,13,15H,14H2,1-2H3
InChIKeyKBKUWUZWNJKBLC-UHFFFAOYSA-N
XLogP2.32
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-dimethoxyphenyl)-thiophen-3-ylmethanamine
CID 43464043
[(2,5-dimethoxyphenyl)-(4-ethylphenyl)methyl]hydrazine
CID 105197445
[(3-methoxythiophen-2-yl)-thiophen-3-ylmethyl]hydrazine
CID 105312089
[(3-bromo-5-chlorophenyl)-(2,5-dimethoxyphenyl)methyl]hydrazine
CID 107948215
[(2,5-dimethoxyphenyl)-(2-methyl-1,3-thiazol-4-yl)methyl]hydrazine
CID 105305100
[(5-chloro-2-methoxyphenyl)-(4-methoxyphenyl)methyl]hydrazine
CID 105190998
N-[(2,4-dimethoxyphenyl)-thiophen-3-ylmethyl]propan-1-amine
CID 43496041
1-(5-chloro-2-methoxyphenyl)-N-methyl-1-thiophen-3-ylmethanamine
CID 62791195
[(2,5-dimethoxyphenyl)-(2-fluoro-3-methylphenyl)methyl]hydrazine
CID 105305140
4-bromo-2-[(2,5-dimethoxyphenyl)-hydrazinylmethyl]aniline
CID 105263567
[(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine
CID 105305151
[1-(2,5-dimethoxyphenyl)-2-methylpropyl]hydrazine
CID 105199640

Frequently Asked Questions

What is the IUPAC name of [(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine?
The IUPAC name of [(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine (CID 105196872) is [(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine.
What is the SMILES notation for [(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine?
The canonical SMILES for [(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine is COc1ccc(OC)c(C(NN)c2ccsc2)c1.
What is the InChIKey of [(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine?
The InChIKey is KBKUWUZWNJKBLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2S/c1-16-10-3-4-12(17-2)11(7-10)13(15-14)9-5-6-18-8-9/h3-8,13,15H,14H2,1-2H3.
What are the key properties of [(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine?
[(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine has a molecular weight of 264.35 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine is sourced from PubChem (CID 105196872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).