2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide

C20H24N2O4 — CID 4940013

IUPAC2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide
SMILESCC(Oc1ccccc1)C(=O)NNC(=O)COc1ccc(C(C)C)cc1
InChIInChI=1S/C20H24N2O4/c1-14(2)16-9-11-17(12-10-16)25-13-19(23)21-22-20(24)15(3)26-18-7-5-4-6-8-18/h4-12,14-15H,13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyWORWKYWTUJJIKP-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.80
Rot. Bonds7

About 2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide

2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide (PubChem CID 4940013) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide.

Molecular Properties

Compound Name2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide
PubChem CID4940013
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide
SMILESCC(Oc1ccccc1)C(=O)NNC(=O)COc1ccc(C(C)C)cc1
InChIInChI=1S/C20H24N2O4/c1-14(2)16-9-11-17(12-10-16)25-13-19(23)21-22-20(24)15(3)26-18-7-5-4-6-8-18/h4-12,14-15H,13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyWORWKYWTUJJIKP-UHFFFAOYSA-N
XLogP2.80
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 ≤ 52.80
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-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]butanehydrazide
CID 4929692
N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 108541576
(2S)-N'-[2-(4-ethylphenoxy)acetyl]-2-(4-propan-2-ylphenoxy)propanehydrazide
CID 9241096
N'-[2-(3-methylphenoxy)acetyl]-2-(4-propan-2-ylphenoxy)propanehydrazide
CID 4953842
N'-[2-(2-methylphenoxy)acetyl]-2-(4-propan-2-ylphenoxy)propanehydrazide
CID 4953840
(2S)-N'-[2-(4-nitrophenoxy)acetyl]-2-(4-propan-2-ylphenoxy)propanehydrazide
CID 9240937
3-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide
CID 19168024
N'-[2-(4-bromo-3-methylphenoxy)acetyl]-2-(4-propan-2-ylphenoxy)propanehydrazide
CID 4953866
2-(3-bromophenoxy)-N'-(2-phenoxyacetyl)propanehydrazide
CID 51161488
(2S)-N'-[2-(4-methoxyphenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide
CID 8757594
N'-[2-(4-ethoxyphenoxy)propanoyl]-2-phenoxypropanehydrazide
CID 42908805
(2R)-2-(4-ethylphenoxy)-N'-[2-(4-ethylphenoxy)acetyl]propanehydrazide
CID 9238118

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide?
The IUPAC name of 2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide (CID 4940013) is 2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide.
What is the SMILES notation for 2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide?
The canonical SMILES for 2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide is CC(Oc1ccccc1)C(=O)NNC(=O)COc1ccc(C(C)C)cc1.
What is the InChIKey of 2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide?
The InChIKey is WORWKYWTUJJIKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-14(2)16-9-11-17(12-10-16)25-13-19(23)21-22-20(24)15(3)26-18-7-5-4-6-8-18/h4-12,14-15H,13H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of 2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide?
2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide has a molecular weight of 356.42 g/mol, XLogP of 2.80, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]propanehydrazide is sourced from PubChem (CID 4940013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).