N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide

C17H21N3O3 — CID 2640774

IUPACN'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide
SMILESN#Cc1ccccc1OCC(=O)NNC(=O)CCC1CCCC1
InChIInChI=1S/C17H21N3O3/c18-11-14-7-3-4-8-15(14)23-12-17(22)20-19-16(21)10-9-13-5-1-2-6-13/h3-4,7-8,13H,1-2,5-6,9-10,12H2,(H,19,21)(H,20,22)
InChIKeyMHKWUTGSSCPYIF-UHFFFAOYSA-N
MW315.37 g/mol
LogP2.05
Rot. Bonds6

About N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide

N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide (PubChem CID 2640774) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide.

Molecular Properties

Compound NameN'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide
PubChem CID2640774
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC NameN'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide
SMILESN#Cc1ccccc1OCC(=O)NNC(=O)CCC1CCCC1
InChIInChI=1S/C17H21N3O3/c18-11-14-7-3-4-8-15(14)23-12-17(22)20-19-16(21)10-9-13-5-1-2-6-13/h3-4,7-8,13H,1-2,5-6,9-10,12H2,(H,19,21)(H,20,22)
InChIKeyMHKWUTGSSCPYIF-UHFFFAOYSA-N
XLogP2.05
TPSA91.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-Methylphenoxy)acetohydrazide
CID 692247
N'-[2-(2,5-dimethylphenoxy)acetyl]cyclobutanecarbohydrazide
CID 2677291
N'-[2-(4-methoxyphenoxy)acetyl]-3-phenylpropanehydrazide
CID 3127332
N'-(2-phenoxyacetyl)-3-phenylpropanehydrazide
CID 3139321
N'-[(2-methylphenoxy)acetyl]-3-phenylpropanehydrazide
CID 3139322
N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide
CID 24979804
N'-[2-(4-butan-2-ylphenoxy)acetyl]cyclohexanecarbohydrazide
CID 2965045
N'-[2-(4-bromophenoxy)acetyl]-3-cyclopentylpropanehydrazide
CID 2079636
N'-[2-(4-cyanophenoxy)acetyl]cyclohexanecarbohydrazide
CID 2407482
N'-[2-(4-ethylphenoxy)acetyl]cyclobutanecarbohydrazide
CID 8746373
2-(2-Benzylphenoxy)acetohydrazide
CID 2345197
2-(2-Cyanophenoxy)acetohydrazide
CID 552149

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide?
The IUPAC name of N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide (CID 2640774) is N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide.
What is the SMILES notation for N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide?
The canonical SMILES for N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide is N#Cc1ccccc1OCC(=O)NNC(=O)CCC1CCCC1.
What is the InChIKey of N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide?
The InChIKey is MHKWUTGSSCPYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3/c18-11-14-7-3-4-8-15(14)23-12-17(22)20-19-16(21)10-9-13-5-1-2-6-13/h3-4,7-8,13H,1-2,5-6,9-10,12H2,(H,19,21)(H,20,22).
What are the key properties of N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide?
N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide has a molecular weight of 315.37 g/mol, XLogP of 2.05, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide is sourced from PubChem (CID 2640774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).