[(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine

C13H18N4OS — CID 105291606

IUPAC[(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
SMILESCCc1nnsc1C(NN)c1ccc(OC)cc1C
InChIInChI=1S/C13H18N4OS/c1-4-11-13(19-17-16-11)12(15-14)10-6-5-9(18-3)7-8(10)2/h5-7,12,15H,4,14H2,1-3H3
InChIKeyBZUYBQKIAQNNNS-UHFFFAOYSA-N
MW278.38 g/mol
LogP1.97
Rot. Bonds5

About [(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine

[(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine (PubChem CID 105291606) has the molecular formula C13H18N4OS and a molecular weight of 278.38 g/mol. Its IUPAC name is [(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
PubChem CID105291606
Molecular FormulaC13H18N4OS
Molecular Weight278.38 g/mol
Exact Mass278.12
IUPAC Name[(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
SMILESCCc1nnsc1C(NN)c1ccc(OC)cc1C
InChIInChI=1S/C13H18N4OS/c1-4-11-13(19-17-16-11)12(15-14)10-6-5-9(18-3)7-8(10)2/h5-7,12,15H,4,14H2,1-3H3
InChIKeyBZUYBQKIAQNNNS-UHFFFAOYSA-N
XLogP1.97
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 51.97
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

1-(4-methoxy-2-methylphenyl)-N-methyl-1-(4-propylthiadiazol-5-yl)methanamine
CID 105115184
N-[(2,4-dimethoxyphenyl)-(4-ethylthiadiazol-5-yl)methyl]ethanamine
CID 105145170
1-(2,5-dimethoxyphenyl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
CID 105145714
[(4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105318787
1-(3,5-dimethoxyphenyl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
CID 105168316
[(2,6-dimethyl-3-pyridinyl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105291511
[(4-fluoro-2-methylphenyl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105256746
[(4-ethylthiadiazol-5-yl)-(3-methoxypyrazin-2-yl)methyl]hydrazine
CID 105332698
[(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105304599
[(2,3-dimethylphenyl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105291474
[(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105301889
[(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 107970130

Frequently Asked Questions

What is the IUPAC name of [(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine?
The IUPAC name of [(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine (CID 105291606) is [(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine is CCc1nnsc1C(NN)c1ccc(OC)cc1C.
What is the InChIKey of [(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine?
The InChIKey is BZUYBQKIAQNNNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4OS/c1-4-11-13(19-17-16-11)12(15-14)10-6-5-9(18-3)7-8(10)2/h5-7,12,15H,4,14H2,1-3H3.
What are the key properties of [(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine?
[(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine has a molecular weight of 278.38 g/mol, XLogP of 1.97, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 105291606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).