[3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine

C16H28N2O3 — CID 105330965

IUPAC[3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine
SMILESCCC(CC)CC(NN)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C16H28N2O3/c1-6-11(7-2)8-13(18-17)12-9-14(19-3)16(21-5)15(10-12)20-4/h9-11,13,18H,6-8,17H2,1-5H3
InChIKeyCXVBBZUZBWHOFF-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.04
Rot. Bonds9

About [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine

[3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine (PubChem CID 105330965) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine.

Molecular Properties

Compound Name[3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine
PubChem CID105330965
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC Name[3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine
SMILESCCC(CC)CC(NN)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C16H28N2O3/c1-6-11(7-2)8-13(18-17)12-9-14(19-3)16(21-5)15(10-12)20-4/h9-11,13,18H,6-8,17H2,1-5H3
InChIKeyCXVBBZUZBWHOFF-UHFFFAOYSA-N
XLogP3.04
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.04
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'}

Analyze [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]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

3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine
CID 105028365
1-(3-chloro-4,5-dimethoxyphenyl)-3-ethyl-N-methylpentan-1-amine
CID 82923305
[4,4,4-trifluoro-1-(3,4,5-trimethoxyphenyl)butyl]hydrazine
CID 105313821
[5-methyl-1-(3,4,5-trimethoxyphenyl)hexyl]hydrazine
CID 105331209
[1-(3,5-dimethoxyphenyl)-3-ethylheptyl]hydrazine
CID 105288416
[1-(3,4-dimethoxyphenyl)-3-ethylheptyl]hydrazine
CID 105192141
[3-ethyl-1-(3-methoxy-4-methylphenyl)heptyl]hydrazine
CID 105288242
1-(3-chloro-4,5-dimethoxyphenyl)hexylhydrazine
CID 105204626
N-cyclopropyl-1-(3,4,5-trimethoxyphenyl)ethane-1,2-diamine
CID 55030744
[1-(3-chloro-4,5-dimethoxyphenyl)-3-methylidenepentyl]hydrazine
CID 105204631
[1-(3-chloro-4,5-dimethoxyphenyl)-2-cyclopropylethyl]hydrazine
CID 105204535
1-(3,4,5-trimethoxyphenyl)butane-1,3-diamine
CID 116933323

Frequently Asked Questions

What is the IUPAC name of [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine?
The IUPAC name of [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine (CID 105330965) is [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine.
What is the SMILES notation for [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine?
The canonical SMILES for [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine is CCC(CC)CC(NN)c1cc(OC)c(OC)c(OC)c1.
What is the InChIKey of [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine?
The InChIKey is CXVBBZUZBWHOFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-6-11(7-2)8-13(18-17)12-9-14(19-3)16(21-5)15(10-12)20-4/h9-11,13,18H,6-8,17H2,1-5H3.
What are the key properties of [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine?
[3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine has a molecular weight of 296.41 g/mol, XLogP of 3.04, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine is sourced from PubChem (CID 105330965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).