(2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide

C20H24N2O4 — CID 40623782

IUPAC(2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide
SMILESCC[C@@H](Oc1ccccc1)C(=O)NNC(=O)COc1cc(C)ccc1C
InChIInChI=1S/C20H24N2O4/c1-4-17(26-16-8-6-5-7-9-16)20(24)22-21-19(23)13-25-18-12-14(2)10-11-15(18)3/h5-12,17H,4,13H2,1-3H3,(H,21,23)(H,22,24)/t17-/m1/s1
InChIKeyPRRUVZMKIWGAHU-QGZVFWFLSA-N
MW356.42 g/mol
LogP2.69
Rot. Bonds7

About (2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide

(2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide (PubChem CID 40623782) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is (2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide.

Molecular Properties

Compound Name(2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide
PubChem CID40623782
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name(2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide
SMILESCC[C@@H](Oc1ccccc1)C(=O)NNC(=O)COc1cc(C)ccc1C
InChIInChI=1S/C20H24N2O4/c1-4-17(26-16-8-6-5-7-9-16)20(24)22-21-19(23)13-25-18-12-14(2)10-11-15(18)3/h5-12,17H,4,13H2,1-3H3,(H,21,23)(H,22,24)/t17-/m1/s1
InChIKeyPRRUVZMKIWGAHU-QGZVFWFLSA-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-(2,5-dimethylphenoxy)acetyl]-2-phenoxypropanehydrazide
CID 3473295
N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(3-methylphenoxy)butanehydrazide
CID 4928664
N'-[2-(2,3-dimethylphenoxy)acetyl]-2-(4-methylphenoxy)butanehydrazide
CID 17343934
2-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide
CID 4950205
N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(2-methylphenoxy)butanehydrazide
CID 4931994
2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]butanehydrazide
CID 4929692
N'-[2-(1-bromonaphthalen-2-yl)oxyacetyl]-2-(3-methylphenoxy)butanehydrazide
CID 4928719
(2R)-N-(2,5-dimethylphenyl)-2-phenoxybutanamide
CID 871725
N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide
CID 7943424
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-(3-propan-2-ylphenoxy)acetohydrazide
CID 55638715
2-(2,5-dimethylphenoxy)-N-[[(2-phenoxyacetyl)amino]carbamothioyl]acetamide
CID 3462212
3-methyl-N'-(2-phenoxybutanoyl)butanehydrazide
CID 24543011

Frequently Asked Questions

What is the IUPAC name of (2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide?
The IUPAC name of (2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide (CID 40623782) is (2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide.
What is the SMILES notation for (2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide?
The canonical SMILES for (2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide is CC[C@@H](Oc1ccccc1)C(=O)NNC(=O)COc1cc(C)ccc1C.
What is the InChIKey of (2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide?
The InChIKey is PRRUVZMKIWGAHU-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-4-17(26-16-8-6-5-7-9-16)20(24)22-21-19(23)13-25-18-12-14(2)10-11-15(18)3/h5-12,17H,4,13H2,1-3H3,(H,21,23)(H,22,24)/t17-/m1/s1.
What are the key properties of (2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide?
(2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide 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 (2R)-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxybutanehydrazide is sourced from PubChem (CID 40623782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).