N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide

C25H26N2O3 — CID 7943424

IUPACN'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide
SMILESCc1ccc(C)c(OCC(=O)NNC(=O)CC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C25H26N2O3/c1-18-13-14-19(2)23(15-18)30-17-25(29)27-26-24(28)16-22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-15,22H,16-17H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyRHZICQGSFZVNFY-UHFFFAOYSA-N
MW402.49 g/mol
LogP4.05
Rot. Bonds7

About N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide

N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide (PubChem CID 7943424) has the molecular formula C25H26N2O3 and a molecular weight of 402.49 g/mol. Its IUPAC name is N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide.

Molecular Properties

Compound NameN'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide
PubChem CID7943424
Molecular FormulaC25H26N2O3
Molecular Weight402.49 g/mol
Exact Mass402.19
IUPAC NameN'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide
SMILESCc1ccc(C)c(OCC(=O)NNC(=O)CC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C25H26N2O3/c1-18-13-14-19(2)23(15-18)30-17-25(29)27-26-24(28)16-22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-15,22H,16-17H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyRHZICQGSFZVNFY-UHFFFAOYSA-N
XLogP4.05
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.49
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[[2-(2,5-dimethylphenoxy)acetyl]amino]-3-phenylpropanoic acid
CID 45461286
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-methoxyacetohydrazide
CID 47102429
N'-(2-chloroacetyl)-2-(2,5-dimethylphenoxy)acetohydrazide
CID 166414788
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-(3-propan-2-ylphenoxy)acetohydrazide
CID 55638715
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-(2-fluorophenoxy)acetohydrazide
CID 7943429
N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide
CID 4119313
2-(2,5-dimethylphenoxy)-N-[(2-methylphenyl)-phenylmethyl]acetamide
CID 43909084
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxypropanehydrazide
CID 3473295
2-(2,5-dimethylphenoxy)-N-[(1R)-2-[(R)-methylsulfinyl]-1-phenylethyl]acetamide
CID 95778372
2-(2,5-dimethylphenoxy)-N-[2-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]acetamide
CID 1012654
(2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide
CID 40623782
2-(2,5-dimethylphenoxy)-N-[[(2-phenoxyacetyl)amino]carbamothioyl]acetamide
CID 3462212

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide?
The IUPAC name of N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide (CID 7943424) is N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide.
What is the SMILES notation for N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide?
The canonical SMILES for N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide is Cc1ccc(C)c(OCC(=O)NNC(=O)CC(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide?
The InChIKey is RHZICQGSFZVNFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O3/c1-18-13-14-19(2)23(15-18)30-17-25(29)27-26-24(28)16-22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-15,22H,16-17H2,1-2H3,(H,26,28)(H,27,29).
What are the key properties of N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide?
N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide has a molecular weight of 402.49 g/mol, XLogP of 4.05, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide is sourced from PubChem (CID 7943424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).