[(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine

C16H28N2OS — CID 105277891

IUPAC[(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine
SMILESCCOC1(C(NN)c2sccc2C)CCC(C)(C)CC1
InChIInChI=1S/C16H28N2OS/c1-5-19-16(9-7-15(3,4)8-10-16)14(18-17)13-12(2)6-11-20-13/h6,11,14,18H,5,7-10,17H2,1-4H3
InChIKeyNRWJJOOQPIDEJR-UHFFFAOYSA-N
MW296.48 g/mol
LogP3.94
Rot. Bonds5

About [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine

[(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine (PubChem CID 105277891) has the molecular formula C16H28N2OS and a molecular weight of 296.48 g/mol. Its IUPAC name is [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine
PubChem CID105277891
Molecular FormulaC16H28N2OS
Molecular Weight296.48 g/mol
Exact Mass296.19
IUPAC Name[(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine
SMILESCCOC1(C(NN)c2sccc2C)CCC(C)(C)CC1
InChIInChI=1S/C16H28N2OS/c1-5-19-16(9-7-15(3,4)8-10-16)14(18-17)13-12(2)6-11-20-13/h6,11,14,18H,5,7-10,17H2,1-4H3
InChIKeyNRWJJOOQPIDEJR-UHFFFAOYSA-N
XLogP3.94
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.48
LogP ≤ 53.94
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 [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-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

1-(1-ethoxy-4-methylcyclohexyl)-N-methyl-1-(3-methylthiophen-2-yl)methanamine
CID 116767194
N-[(3-bromothiophen-2-yl)-(1-ethoxy-4,4-dimethylcyclohexyl)methyl]ethanamine
CID 116768848
[(3-bromothiophen-2-yl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine
CID 105277390
[(3-bromothiophen-2-yl)-(4-ethoxyoxan-4-yl)methyl]hydrazine
CID 105276955
[(4-chlorophenyl)-(1-ethoxy-4,4-dimethylcyclohexyl)methyl]hydrazine
CID 105277877
[(5-chlorothiophen-2-yl)-(1-ethoxy-4,4-dimethylcyclohexyl)methyl]hydrazine
CID 105277901
1-(1-ethoxy-4,4-dimethylcyclohexyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 116768795
[(2-methyloxolan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105250846
2-(3-bromothiophen-2-yl)-1-(1-ethoxy-4,4-dimethylcyclohexyl)ethanamine
CID 116768615
1-(1-ethoxy-4,4-dimethylcyclohexyl)-N-methyl-1-(5-methylthiophen-2-yl)methanamine
CID 116768821
[3,4-dihydro-2H-pyran-5-yl-(1-ethoxy-4,4-dimethylcyclohexyl)methyl]hydrazine
CID 105277842
[1-(1-ethoxy-4,4-dimethylcyclohexyl)-2,2-dimethylpropyl]hydrazine
CID 105277919

Frequently Asked Questions

What is the IUPAC name of [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine (CID 105277891) is [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine is CCOC1(C(NN)c2sccc2C)CCC(C)(C)CC1.
What is the InChIKey of [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine?
The InChIKey is NRWJJOOQPIDEJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2OS/c1-5-19-16(9-7-15(3,4)8-10-16)14(18-17)13-12(2)6-11-20-13/h6,11,14,18H,5,7-10,17H2,1-4H3.
What are the key properties of [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine?
[(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine has a molecular weight of 296.48 g/mol, XLogP of 3.94, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-ethoxy-4,4-dimethylcyclohexyl)-(3-methylthiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 105277891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).