2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide

C16H25N3O2 — CID 63574053

IUPAC2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide
SMILESCCN(CCOc1ccccc1C(=O)NN)C1CCCC1
InChIInChI=1S/C16H25N3O2/c1-2-19(13-7-3-4-8-13)11-12-21-15-10-6-5-9-14(15)16(20)18-17/h5-6,9-10,13H,2-4,7-8,11-12,17H2,1H3,(H,18,20)
InChIKeyIVCGXSNXDHIPAC-UHFFFAOYSA-N
MW291.39 g/mol
LogP1.93
Rot. Bonds7

About 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide

2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide (PubChem CID 63574053) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide.

Molecular Properties

Compound Name2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide
PubChem CID63574053
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Name2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide
SMILESCCN(CCOc1ccccc1C(=O)NN)C1CCCC1
InChIInChI=1S/C16H25N3O2/c1-2-19(13-7-3-4-8-13)11-12-21-15-10-6-5-9-14(15)16(20)18-17/h5-6,9-10,13H,2-4,7-8,11-12,17H2,1H3,(H,18,20)
InChIKeyIVCGXSNXDHIPAC-UHFFFAOYSA-N
XLogP1.93
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide 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-[2-[2-[cyclopropyl(ethyl)amino]ethoxy]phenyl]ethanone
CID 43426605
4-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide
CID 63573866
2-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]benzohydrazide
CID 63571903
2-[2-[butyl(ethyl)amino]ethoxy]benzohydrazide
CID 63569772
2-[2-[butan-2-yl(ethyl)amino]ethoxy]benzohydrazide
CID 63572715
2-(2-cycloheptyloxyethoxy)benzohydrazide
CID 63570919
2-[[cyclohexyl(ethyl)amino]methyl]benzohydrazide
CID 63571134
2-pentoxybenzohydrazide
CID 54793215
2-[2-(4-methylcyclohexyl)oxyethoxy]benzohydrazide
CID 63575926
2-[2-[ethyl(2-methylbutyl)amino]ethoxy]benzohydrazide
CID 79482895
1-[2-[2-[cycloheptyl(methyl)amino]ethoxy]phenyl]ethanone
CID 43233074
2-[2-(cyclopentylmethylsulfanyl)ethoxy]benzohydrazide
CID 63589929

Frequently Asked Questions

What is the IUPAC name of 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide?
The IUPAC name of 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide (CID 63574053) is 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide.
What is the SMILES notation for 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide?
The canonical SMILES for 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide is CCN(CCOc1ccccc1C(=O)NN)C1CCCC1.
What is the InChIKey of 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide?
The InChIKey is IVCGXSNXDHIPAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-2-19(13-7-3-4-8-13)11-12-21-15-10-6-5-9-14(15)16(20)18-17/h5-6,9-10,13H,2-4,7-8,11-12,17H2,1H3,(H,18,20).
What are the key properties of 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide?
2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide has a molecular weight of 291.39 g/mol, XLogP of 1.93, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide is sourced from PubChem (CID 63574053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).