[(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine

C14H22N2OS — CID 105304446

IUPAC[(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine
SMILESCCOc1ccccc1C(NN)C1(C)CCCS1
InChIInChI=1S/C14H22N2OS/c1-3-17-12-8-5-4-7-11(12)13(16-15)14(2)9-6-10-18-14/h4-5,7-8,13,16H,3,6,9-10,15H2,1-2H3
InChIKeyZBRNVNOWVPDDEF-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.88
Rot. Bonds5

About [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine

[(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine (PubChem CID 105304446) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine
PubChem CID105304446
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name[(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine
SMILESCCOc1ccccc1C(NN)C1(C)CCCS1
InChIInChI=1S/C14H22N2OS/c1-3-17-12-8-5-4-7-11(12)13(16-15)14(2)9-6-10-18-14/h4-5,7-8,13,16H,3,6,9-10,15H2,1-2H3
InChIKeyZBRNVNOWVPDDEF-UHFFFAOYSA-N
XLogP2.88
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]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

(2-methylthiolan-2-yl)-(2-propoxyphenyl)methanamine
CID 105180756
[[2-(2-methoxyethoxy)phenyl]-(1-methylcyclohexyl)methyl]hydrazine
CID 106831356
N-[(3-methoxy-2-pyridinyl)-(2-methylthiolan-2-yl)methyl]ethanamine
CID 114054541
N-[(4-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]propan-1-amine
CID 105140867
[(3,4-dimethylphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine
CID 105300299
[(2-methylthiolan-2-yl)-pyrazin-2-ylmethyl]hydrazine
CID 105308748
[(2-methylpyrazol-3-yl)-(2-methylthiolan-2-yl)methyl]hydrazine
CID 105307514
N-[(2-ethoxyphenyl)-(1-methoxycyclopentyl)methyl]propan-1-amine
CID 104611341
[(1-methylcyclohexyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 106831316
(1S)-1-(2-ethoxyphenyl)propan-1-amine;hydrochloride
CID 171221746
1-(2-ethoxyphenyl)-N,2-dimethylprop-2-en-1-amine
CID 115533805
[3-cyclohexyl-1-(2-ethoxyphenyl)propyl]hydrazine
CID 105304395

Frequently Asked Questions

What is the IUPAC name of [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine?
The IUPAC name of [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine (CID 105304446) is [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine.
What is the SMILES notation for [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine?
The canonical SMILES for [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine is CCOc1ccccc1C(NN)C1(C)CCCS1.
What is the InChIKey of [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine?
The InChIKey is ZBRNVNOWVPDDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-3-17-12-8-5-4-7-11(12)13(16-15)14(2)9-6-10-18-14/h4-5,7-8,13,16H,3,6,9-10,15H2,1-2H3.
What are the key properties of [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine?
[(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine has a molecular weight of 266.41 g/mol, XLogP of 2.88, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-ethoxyphenyl)-(2-methylthiolan-2-yl)methyl]hydrazine is sourced from PubChem (CID 105304446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).