2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide

C20H24N2O4 — CID 4950205

IUPAC2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide
SMILESCCC(Oc1ccc(C)cc1)C(=O)NNC(=O)COc1ccc(C)cc1
InChIInChI=1S/C20H24N2O4/c1-4-18(26-17-11-7-15(3)8-12-17)20(24)22-21-19(23)13-25-16-9-5-14(2)6-10-16/h5-12,18H,4,13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyFIDRBGYXCPZOAZ-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.69
Rot. Bonds7

About 2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide

2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide (PubChem CID 4950205) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide
PubChem CID4950205
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide
SMILESCCC(Oc1ccc(C)cc1)C(=O)NNC(=O)COc1ccc(C)cc1
InChIInChI=1S/C20H24N2O4/c1-4-18(26-17-11-7-15(3)8-12-17)20(24)22-21-19(23)13-25-16-9-5-14(2)6-10-16/h5-12,18H,4,13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyFIDRBGYXCPZOAZ-UHFFFAOYSA-N
XLogP2.69
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.69
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

N'-[2-(2,3-dimethylphenoxy)acetyl]-2-(4-methylphenoxy)butanehydrazide
CID 17343934
N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide
CID 17073439
2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]butanehydrazide
CID 4929692
N'-[2-(2-bromo-4-tert-butylphenoxy)acetyl]-2-(4-methylphenoxy)butanehydrazide
CID 4950294
(2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide
CID 40623782
(2S)-2-(4-methylphenoxy)-N-[2-[[(2S)-2-(4-methylphenoxy)butanoyl]amino]ethyl]butanamide
CID 40796762
(2R)-N-methyl-2-(4-methylphenoxy)butanamide
CID 40742854
4-[2-[2-(4-methylphenoxy)butanoyl]hydrazinyl]-4-oxo-N-phenylbutanamide
CID 4950203
N'-[2-(4-methylphenoxy)acetyl]propanehydrazide
CID 4635692
2-methyl-N'-[2-[4-(4-methylphenoxy)phenoxy]acetyl]propanehydrazide
CID 24633512
N-(2,4-dimethylphenyl)-4-[2-[(2S)-2-(4-methylphenoxy)butanoyl]hydrazinyl]-4-oxobutanamide
CID 42426908
N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(3-methylphenoxy)butanehydrazide
CID 4928664

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide?
The IUPAC name of 2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide (CID 4950205) is 2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide.
What is the SMILES notation for 2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide?
The canonical SMILES for 2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide is CCC(Oc1ccc(C)cc1)C(=O)NNC(=O)COc1ccc(C)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide?
The InChIKey is FIDRBGYXCPZOAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-4-18(26-17-11-7-15(3)8-12-17)20(24)22-21-19(23)13-25-16-9-5-14(2)6-10-16/h5-12,18H,4,13H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of 2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide?
2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide has a molecular weight of 356.42 g/mol, XLogP of 2.69, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide is sourced from PubChem (CID 4950205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).