4-(2-pent-4-enoxyethoxy)benzohydrazide

C14H20N2O3 — CID 79114465

IUPAC4-(2-pent-4-enoxyethoxy)benzohydrazide
SMILESC=CCCCOCCOc1ccc(C(=O)NN)cc1
InChIInChI=1S/C14H20N2O3/c1-2-3-4-9-18-10-11-19-13-7-5-12(6-8-13)14(17)16-15/h2,5-8H,1,3-4,9-11,15H2,(H,16,17)
InChIKeyQHMPYCURHNNEAL-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.65
Rot. Bonds9

About 4-(2-pent-4-enoxyethoxy)benzohydrazide

4-(2-pent-4-enoxyethoxy)benzohydrazide (PubChem CID 79114465) has the molecular formula C14H20N2O3 and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-(2-pent-4-enoxyethoxy)benzohydrazide.

Molecular Properties

Compound Name4-(2-pent-4-enoxyethoxy)benzohydrazide
PubChem CID79114465
Molecular FormulaC14H20N2O3
Molecular Weight264.33 g/mol
Exact Mass264.15
IUPAC Name4-(2-pent-4-enoxyethoxy)benzohydrazide
SMILESC=CCCCOCCOc1ccc(C(=O)NN)cc1
InChIInChI=1S/C14H20N2O3/c1-2-3-4-9-18-10-11-19-13-7-5-12(6-8-13)14(17)16-15/h2,5-8H,1,3-4,9-11,15H2,(H,16,17)
InChIKeyQHMPYCURHNNEAL-UHFFFAOYSA-N
XLogP1.65
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.65
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': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(2-butoxyethoxy)benzohydrazide
CID 55214383
4-[2-(2-cyclopropylethoxy)ethoxy]benzohydrazide
CID 106206530
4-[2-(2-propan-2-yloxyethoxy)ethoxy]benzohydrazide
CID 63576109
4-(4-pent-4-enoxyphenyl)benzoic acid
CID 19419405
4-(8-but-3-enoxyoctoxy)benzoic acid
CID 19797910
4-[2-(4-iodophenoxy)ethoxy]benzohydrazide
CID 63576077
4-pentoxybenzohydrazide
CID 2727702
4-[2-(cyclohexylmethoxy)ethoxy]benzohydrazide
CID 63570015
[1,4-dihydroxy-4-(4-pent-4-enoxybenzoyl)cyclohexa-2,5-dien-1-yl]-(4-pent-4-enoxyphenyl)methanone
CID 68509388
(4-hex-5-enoxyphenyl) 4-hex-5-enoxybenzoate
CID 86174635
4-undec-10-enoxybenzoate
CID 7009276
methane;1-[4-[2-(2-prop-2-enoxyethoxy)ethoxy]phenyl]ethanone
CID 161243882

Frequently Asked Questions

What is the IUPAC name of 4-(2-pent-4-enoxyethoxy)benzohydrazide?
The IUPAC name of 4-(2-pent-4-enoxyethoxy)benzohydrazide (CID 79114465) is 4-(2-pent-4-enoxyethoxy)benzohydrazide.
What is the SMILES notation for 4-(2-pent-4-enoxyethoxy)benzohydrazide?
The canonical SMILES for 4-(2-pent-4-enoxyethoxy)benzohydrazide is C=CCCCOCCOc1ccc(C(=O)NN)cc1.
What is the InChIKey of 4-(2-pent-4-enoxyethoxy)benzohydrazide?
The InChIKey is QHMPYCURHNNEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-2-3-4-9-18-10-11-19-13-7-5-12(6-8-13)14(17)16-15/h2,5-8H,1,3-4,9-11,15H2,(H,16,17).
What are the key properties of 4-(2-pent-4-enoxyethoxy)benzohydrazide?
4-(2-pent-4-enoxyethoxy)benzohydrazide has a molecular weight of 264.33 g/mol, XLogP of 1.65, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-pent-4-enoxyethoxy)benzohydrazide is sourced from PubChem (CID 79114465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).