2-(2-cycloheptyloxyethoxy)benzohydrazide

C16H24N2O3 — CID 63570919

IUPAC2-(2-cycloheptyloxyethoxy)benzohydrazide
SMILESNNC(=O)c1ccccc1OCCOC1CCCCCC1
InChIInChI=1S/C16H24N2O3/c17-18-16(19)14-9-5-6-10-15(14)21-12-11-20-13-7-3-1-2-4-8-13/h5-6,9-10,13H,1-4,7-8,11-12,17H2,(H,18,19)
InChIKeyNDBDPOBONLCADQ-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.41
Rot. Bonds6

About 2-(2-cycloheptyloxyethoxy)benzohydrazide

2-(2-cycloheptyloxyethoxy)benzohydrazide (PubChem CID 63570919) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(2-cycloheptyloxyethoxy)benzohydrazide.

Molecular Properties

Compound Name2-(2-cycloheptyloxyethoxy)benzohydrazide
PubChem CID63570919
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(2-cycloheptyloxyethoxy)benzohydrazide
SMILESNNC(=O)c1ccccc1OCCOC1CCCCCC1
InChIInChI=1S/C16H24N2O3/c17-18-16(19)14-9-5-6-10-15(14)21-12-11-20-13-7-3-1-2-4-8-13/h5-6,9-10,13H,1-4,7-8,11-12,17H2,(H,18,19)
InChIKeyNDBDPOBONLCADQ-UHFFFAOYSA-N
XLogP2.41
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(4-methylcyclohexyl)oxyethoxy]benzohydrazide
CID 63575926
2-(2-cyclobutyloxyethoxy)benzoic acid
CID 62115794
2-[2-(cyclopentylmethylsulfanyl)ethoxy]benzohydrazide
CID 63589929
2-[2-[cyclopentyl(ethyl)amino]ethoxy]benzohydrazide
CID 63574053
2-[2-(2-iodophenoxy)ethoxy]benzohydrazide
CID 63570332
2-(cyclobutyloxymethyl)benzohydrazide
CID 63568933
2-(2-prop-2-enoxyethoxy)benzohydrazide
CID 63576125
2-(2-cyclobutyloxyethoxy)aniline
CID 62116635
2-[2-(4-methylpentan-2-yloxy)ethoxy]benzohydrazide
CID 63574572
2-pentoxybenzohydrazide
CID 54793215
1-[2-[2-(3-methylcyclohexyl)oxyethoxy]phenyl]ethanone
CID 43793785
2-(cyclopentyloxymethoxy)benzoic acid
CID 68845685

Frequently Asked Questions

What is the IUPAC name of 2-(2-cycloheptyloxyethoxy)benzohydrazide?
The IUPAC name of 2-(2-cycloheptyloxyethoxy)benzohydrazide (CID 63570919) is 2-(2-cycloheptyloxyethoxy)benzohydrazide.
What is the SMILES notation for 2-(2-cycloheptyloxyethoxy)benzohydrazide?
The canonical SMILES for 2-(2-cycloheptyloxyethoxy)benzohydrazide is NNC(=O)c1ccccc1OCCOC1CCCCCC1.
What is the InChIKey of 2-(2-cycloheptyloxyethoxy)benzohydrazide?
The InChIKey is NDBDPOBONLCADQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c17-18-16(19)14-9-5-6-10-15(14)21-12-11-20-13-7-3-1-2-4-8-13/h5-6,9-10,13H,1-4,7-8,11-12,17H2,(H,18,19).
What are the key properties of 2-(2-cycloheptyloxyethoxy)benzohydrazide?
2-(2-cycloheptyloxyethoxy)benzohydrazide has a molecular weight of 292.38 g/mol, XLogP of 2.41, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cycloheptyloxyethoxy)benzohydrazide is sourced from PubChem (CID 63570919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).