N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide

C16H24N2O4 — CID 4955589

IUPACN'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide
SMILESCCCCCC(=O)NNC(=O)C(C)Oc1ccccc1OC
InChIInChI=1S/C16H24N2O4/c1-4-5-6-11-15(19)17-18-16(20)12(2)22-14-10-8-7-9-13(14)21-3/h7-10,12H,4-6,11H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyQIYJFZBCUYZMEI-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.19
Rot. Bonds8

About N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide

N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide (PubChem CID 4955589) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide.

Molecular Properties

Compound NameN'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide
PubChem CID4955589
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC NameN'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide
SMILESCCCCCC(=O)NNC(=O)C(C)Oc1ccccc1OC
InChIInChI=1S/C16H24N2O4/c1-4-5-6-11-15(19)17-18-16(20)12(2)22-14-10-8-7-9-13(14)21-3/h7-10,12H,4-6,11H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyQIYJFZBCUYZMEI-UHFFFAOYSA-N
XLogP2.19
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide?
The IUPAC name of N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide (CID 4955589) is N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide.
What is the SMILES notation for N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide?
The canonical SMILES for N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide is CCCCCC(=O)NNC(=O)C(C)Oc1ccccc1OC.
What is the InChIKey of N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide?
The InChIKey is QIYJFZBCUYZMEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4/c1-4-5-6-11-15(19)17-18-16(20)12(2)22-14-10-8-7-9-13(14)21-3/h7-10,12H,4-6,11H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide?
N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide has a molecular weight of 308.38 g/mol, XLogP of 2.19, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-methoxyphenoxy)propanoyl]hexanehydrazide is sourced from PubChem (CID 4955589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).