2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide

C26H22N2O3 — CID 4513399

IUPAC2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)NNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C26H22N2O3/c29-25(17-22-11-6-10-21-9-4-5-12-24(21)22)27-28-26(30)18-31-23-15-13-20(14-16-23)19-7-2-1-3-8-19/h1-16H,17-18H2,(H,27,29)(H,28,30)
InChIKeyFCRJTDDRKAWDNO-UHFFFAOYSA-N
MW410.47 g/mol
LogP4.28
Rot. Bonds6

About 2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide

2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide (PubChem CID 4513399) has the molecular formula C26H22N2O3 and a molecular weight of 410.47 g/mol. Its IUPAC name is 2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide.

Molecular Properties

Compound Name2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide
PubChem CID4513399
Molecular FormulaC26H22N2O3
Molecular Weight410.47 g/mol
Exact Mass410.16
IUPAC Name2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)NNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C26H22N2O3/c29-25(17-22-11-6-10-21-9-4-5-12-24(21)22)27-28-26(30)18-31-23-15-13-20(14-16-23)19-7-2-1-3-8-19/h1-16H,17-18H2,(H,27,29)(H,28,30)
InChIKeyFCRJTDDRKAWDNO-UHFFFAOYSA-N
XLogP4.28
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.47
LogP ≤ 54.28
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

N'-(2-naphthalen-2-yloxyacetyl)-2-(4-phenylphenoxy)acetohydrazide
CID 4512962
N'-[2-(4-bromo-3-methylphenoxy)acetyl]-2-naphthalen-1-ylacetohydrazide
CID 3397636
N'-acetyl-2-(4-phenylphenoxy)acetohydrazide
CID 3274977
2-(4-methoxyphenoxy)-N-(naphthalen-1-ylmethyl)acetamide
CID 95945546
N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide
CID 4925965
N'-[2-(2-methoxyphenoxy)acetyl]-2-naphthalen-1-ylacetohydrazide
CID 3480178
N-[4-(2-amino-2-oxoethoxy)phenyl]-2-naphthalen-1-ylacetamide
CID 38381033
2-naphthalen-1-yl-N-[(1R)-1-(4-phenylphenyl)ethyl]acetamide
CID 7948833
(2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide
CID 8960553
N'-[2-(4-methylphenoxy)acetyl]-2-phenylacetohydrazide
CID 968398
N'-[2-(4-methoxyphenoxy)acetyl]-2-(2-methylphenyl)acetohydrazide
CID 26163562
4-oxo-4-[2-[2-(4-phenylphenoxy)acetyl]hydrazinyl]but-2-enoic acid
CID 3272793

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide?
The IUPAC name of 2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide (CID 4513399) is 2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide.
What is the SMILES notation for 2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide?
The canonical SMILES for 2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide is O=C(COc1ccc(-c2ccccc2)cc1)NNC(=O)Cc1cccc2ccccc12.
What is the InChIKey of 2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide?
The InChIKey is FCRJTDDRKAWDNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O3/c29-25(17-22-11-6-10-21-9-4-5-12-24(21)22)27-28-26(30)18-31-23-15-13-20(14-16-23)19-7-2-1-3-8-19/h1-16H,17-18H2,(H,27,29)(H,28,30).
What are the key properties of 2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide?
2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide has a molecular weight of 410.47 g/mol, XLogP of 4.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide is sourced from PubChem (CID 4513399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).