2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide

C25H28N2O4 — CID 17130032

IUPAC2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide
SMILESCCC(C)c1ccccc1OC(C)C(=O)NNC(=O)COc1cccc2ccccc12
InChIInChI=1S/C25H28N2O4/c1-4-17(2)20-12-7-8-14-23(20)31-18(3)25(29)27-26-24(28)16-30-22-15-9-11-19-10-5-6-13-21(19)22/h5-15,17-18H,4,16H2,1-3H3,(H,26,28)(H,27,29)
InChIKeyRNJAECOOXRTBQJ-UHFFFAOYSA-N
MW420.51 g/mol
LogP4.35
Rot. Bonds8

About 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide

2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide (PubChem CID 17130032) has the molecular formula C25H28N2O4 and a molecular weight of 420.51 g/mol. Its IUPAC name is 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide.

Molecular Properties

Compound Name2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide
PubChem CID17130032
Molecular FormulaC25H28N2O4
Molecular Weight420.51 g/mol
Exact Mass420.20
IUPAC Name2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide
SMILESCCC(C)c1ccccc1OC(C)C(=O)NNC(=O)COc1cccc2ccccc12
InChIInChI=1S/C25H28N2O4/c1-4-17(2)20-12-7-8-14-23(20)31-18(3)25(29)27-26-24(28)16-30-22-15-9-11-19-10-5-6-13-21(19)22/h5-15,17-18H,4,16H2,1-3H3,(H,26,28)(H,27,29)
InChIKeyRNJAECOOXRTBQJ-UHFFFAOYSA-N
XLogP4.35
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.51
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-butan-2-ylphenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]propanehydrazide
CID 17130025
2-(2-butan-2-ylphenoxy)-N'-(2-phenylacetyl)propanehydrazide
CID 17129998
(2R)-N'-[2-[2-[(2S)-butan-2-yl]phenoxy]acetyl]-2-(4-ethylphenoxy)propanehydrazide
CID 9237453
2-(2-butan-2-ylphenoxy)-N'-[2-(4-methoxyphenyl)acetyl]propanehydrazide
CID 17129993
2-(2-butan-2-ylphenoxy)-N'-(3-phenylpropanoyl)propanehydrazide
CID 17129978
propyl 4-[2-[2-[2-(2-butan-2-ylphenoxy)propanoyl]hydrazinyl]-2-oxoethoxy]benzoate
CID 17130058
N'-acetyl-2-naphthalen-1-yloxyacetohydrazide
CID 922179
2-(2-butan-2-ylphenoxy)-N'-[2-(2,4-dibromophenoxy)acetyl]butanehydrazide
CID 17150806
(2S)-2-(2,6-dimethylphenoxy)-N'-[2-(2-propan-2-ylphenoxy)acetyl]propanehydrazide
CID 9297781
N'-[2-(2-butan-2-ylphenoxy)propanoyl]-3,4-dimethoxybenzohydrazide
CID 17130050
N-benzyl-2-(2-butan-2-ylphenoxy)propanamide
CID 17129862
N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide
CID 7765844

Frequently Asked Questions

What is the IUPAC name of 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide?
The IUPAC name of 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide (CID 17130032) is 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide.
What is the SMILES notation for 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide?
The canonical SMILES for 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide is CCC(C)c1ccccc1OC(C)C(=O)NNC(=O)COc1cccc2ccccc12.
What is the InChIKey of 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide?
The InChIKey is RNJAECOOXRTBQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O4/c1-4-17(2)20-12-7-8-14-23(20)31-18(3)25(29)27-26-24(28)16-30-22-15-9-11-19-10-5-6-13-21(19)22/h5-15,17-18H,4,16H2,1-3H3,(H,26,28)(H,27,29).
What are the key properties of 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide?
2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide has a molecular weight of 420.51 g/mol, XLogP of 4.35, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butan-2-ylphenoxy)-N'-(2-naphthalen-1-yloxyacetyl)propanehydrazide is sourced from PubChem (CID 17130032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).