[5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine

C11H14N4O2S — CID 80614106

IUPAC[5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine
SMILESCOc1cccc(COCc2nnc(NN)s2)c1
InChIInChI=1S/C11H14N4O2S/c1-16-9-4-2-3-8(5-9)6-17-7-10-14-15-11(13-12)18-10/h2-5H,6-7,12H2,1H3,(H,13,15)
InChIKeyOEJVQLSCFKGUHX-UHFFFAOYSA-N
MW266.33 g/mol
LogP1.55
Rot. Bonds6

About [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine

[5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine (PubChem CID 80614106) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine
PubChem CID80614106
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC Name[5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine
SMILESCOc1cccc(COCc2nnc(NN)s2)c1
InChIInChI=1S/C11H14N4O2S/c1-16-9-4-2-3-8(5-9)6-17-7-10-14-15-11(13-12)18-10/h2-5H,6-7,12H2,1H3,(H,13,15)
InChIKeyOEJVQLSCFKGUHX-UHFFFAOYSA-N
XLogP1.55
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-amine
CID 80608923
[5-[(3-ethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]hydrazine
CID 80613704
5-[(3-methoxyphenyl)methyl]-N-methyl-1,3,4-thiadiazol-2-amine
CID 13272863
[5-[(4-bromophenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine
CID 82831907
[4-[(3-methoxyphenyl)methoxymethyl]-2-pyridinyl]hydrazine
CID 62464124
5-[[(3-methoxyphenyl)methyl-methylamino]methyl]-N-methyl-1,3,4-thiadiazol-2-amine
CID 80607357
[5-[(2-tert-butyl-4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-yl]hydrazine
CID 80601996
[5-[2-(3-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl]methanamine
CID 95459878
3-[(3-methoxyphenyl)methoxymethyl]benzenecarbothioamide
CID 24701742
N-ethyl-5-(phenylmethoxymethyl)-1,3,4-thiadiazol-2-amine
CID 80608751
[5-[(4-methoxy-2-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]hydrazine
CID 80613395
N-[(2-hydrazinyl-1,3-thiazol-5-yl)methyl]-1-(3-methoxyphenyl)-N-methylmethanamine
CID 79763885

Frequently Asked Questions

What is the IUPAC name of [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine?
The IUPAC name of [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine (CID 80614106) is [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine.
What is the SMILES notation for [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine?
The canonical SMILES for [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine is COc1cccc(COCc2nnc(NN)s2)c1.
What is the InChIKey of [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine?
The InChIKey is OEJVQLSCFKGUHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-16-9-4-2-3-8(5-9)6-17-7-10-14-15-11(13-12)18-10/h2-5H,6-7,12H2,1H3,(H,13,15).
What are the key properties of [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine?
[5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine has a molecular weight of 266.33 g/mol, XLogP of 1.55, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(3-methoxyphenyl)methoxymethyl]-1,3,4-thiadiazol-2-yl]hydrazine is sourced from PubChem (CID 80614106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).