4-(2-chlorophenoxy)pentanehydrazide

C11H15ClN2O2 — CID 63574443

IUPAC4-(2-chlorophenoxy)pentanehydrazide
SMILESCC(CCC(=O)NN)Oc1ccccc1Cl
InChIInChI=1S/C11H15ClN2O2/c1-8(6-7-11(15)14-13)16-10-5-3-2-4-9(10)12/h2-5,8H,6-7,13H2,1H3,(H,14,15)
InChIKeyCRJPEFKMKJKTOH-UHFFFAOYSA-N
MW242.71 g/mol
LogP1.88
Rot. Bonds5

About 4-(2-chlorophenoxy)pentanehydrazide

4-(2-chlorophenoxy)pentanehydrazide (PubChem CID 63574443) has the molecular formula C11H15ClN2O2 and a molecular weight of 242.71 g/mol. Its IUPAC name is 4-(2-chlorophenoxy)pentanehydrazide.

Molecular Properties

Compound Name4-(2-chlorophenoxy)pentanehydrazide
PubChem CID63574443
Molecular FormulaC11H15ClN2O2
Molecular Weight242.71 g/mol
Exact Mass242.08
IUPAC Name4-(2-chlorophenoxy)pentanehydrazide
SMILESCC(CCC(=O)NN)Oc1ccccc1Cl
InChIInChI=1S/C11H15ClN2O2/c1-8(6-7-11(15)14-13)16-10-5-3-2-4-9(10)12/h2-5,8H,6-7,13H2,1H3,(H,14,15)
InChIKeyCRJPEFKMKJKTOH-UHFFFAOYSA-N
XLogP1.88
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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'}

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Related Compounds

4-(4-bromo-2-chlorophenoxy)pentanehydrazide
CID 63574538
3-(2-chlorophenoxy)butan-1-ol
CID 82076432
4-(2,4-difluorophenoxy)pentanehydrazide
CID 63575446
N-[2-(2-chlorophenoxy)propyl]-4-(methylamino)butanamide
CID 119725461
4-(3-fluorophenoxy)pentanehydrazide
CID 63575496
methyl (2R,3S)-2-amino-3-(2-chlorophenoxy)butanoate
CID 99737716
methyl 2-amino-3-(2-chlorophenoxy)butanoate
CID 86263211
4-(4-methylsulfanylphenoxy)pentanehydrazide
CID 55246737
2-(2-chlorophenoxy)pentan-3-one
CID 64866523
ethyl 4-[2-(2-chlorophenoxy)propanoylamino]butanoate
CID 60739618
N-[2-(2-chlorophenoxy)propyl]-3-methylbutan-1-amine
CID 62571196
3-amino-N-[2-(2-chlorophenoxy)butyl]propanamide
CID 119340532

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenoxy)pentanehydrazide?
The IUPAC name of 4-(2-chlorophenoxy)pentanehydrazide (CID 63574443) is 4-(2-chlorophenoxy)pentanehydrazide.
What is the SMILES notation for 4-(2-chlorophenoxy)pentanehydrazide?
The canonical SMILES for 4-(2-chlorophenoxy)pentanehydrazide is CC(CCC(=O)NN)Oc1ccccc1Cl.
What is the InChIKey of 4-(2-chlorophenoxy)pentanehydrazide?
The InChIKey is CRJPEFKMKJKTOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O2/c1-8(6-7-11(15)14-13)16-10-5-3-2-4-9(10)12/h2-5,8H,6-7,13H2,1H3,(H,14,15).
What are the key properties of 4-(2-chlorophenoxy)pentanehydrazide?
4-(2-chlorophenoxy)pentanehydrazide has a molecular weight of 242.71 g/mol, XLogP of 1.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenoxy)pentanehydrazide is sourced from PubChem (CID 63574443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).