N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide

C24H24N2O5 — CID 17134452

IUPACN'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide
SMILESCOc1ccc(OCC(=O)NNC(=O)c2cccc(OCCc3ccccc3)c2)cc1
InChIInChI=1S/C24H24N2O5/c1-29-20-10-12-21(13-11-20)31-17-23(27)25-26-24(28)19-8-5-9-22(16-19)30-15-14-18-6-3-2-4-7-18/h2-13,16H,14-15,17H2,1H3,(H,25,27)(H,26,28)
InChIKeyDRPJALJETIXRNZ-UHFFFAOYSA-N
MW420.47 g/mol
LogP3.16
Rot. Bonds9

About N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide

N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide (PubChem CID 17134452) has the molecular formula C24H24N2O5 and a molecular weight of 420.47 g/mol. Its IUPAC name is N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide.

Molecular Properties

Compound NameN'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide
PubChem CID17134452
Molecular FormulaC24H24N2O5
Molecular Weight420.47 g/mol
Exact Mass420.17
IUPAC NameN'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide
SMILESCOc1ccc(OCC(=O)NNC(=O)c2cccc(OCCc3ccccc3)c2)cc1
InChIInChI=1S/C24H24N2O5/c1-29-20-10-12-21(13-11-20)31-17-23(27)25-26-24(28)19-8-5-9-22(16-19)30-15-14-18-6-3-2-4-7-18/h2-13,16H,14-15,17H2,1H3,(H,25,27)(H,26,28)
InChIKeyDRPJALJETIXRNZ-UHFFFAOYSA-N
XLogP3.16
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.47
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(4-methoxyphenoxy)acetyl]-4-(2-phenylethoxy)benzohydrazide
CID 4956591
N'-[2-(4-nitrophenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide
CID 17134509
3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide
CID 17139694
N'-[2-(4-ethylphenoxy)acetyl]-3-(2-phenoxyethoxy)benzohydrazide
CID 4955139
N'-[2-(4-fluorophenoxy)acetyl]-3-methoxybenzohydrazide
CID 8880066
3-(2-phenylethoxy)-N'-[2-(2-phenylphenoxy)acetyl]benzohydrazide
CID 17134455
N'-[2-(3-methylphenoxy)acetyl]-3-(2-phenoxyethoxy)benzohydrazide
CID 4955104
N'-[4-(3-methylbutoxy)benzoyl]-3-(2-phenylethoxy)benzohydrazide
CID 17134546
N'-[2-(1-bromonaphthalen-2-yl)oxyacetyl]-3-(2-phenylethoxy)benzohydrazide
CID 17134491
N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-3-(2-phenylethoxy)benzamide
CID 17134842
3-(2-phenylethoxy)-N-[[[2-(4-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]benzamide
CID 17134801
4-(2-phenylethoxy)-N'-[2-(4-phenylphenoxy)acetyl]benzohydrazide
CID 4956671

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide?
The IUPAC name of N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide (CID 17134452) is N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide.
What is the SMILES notation for N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide?
The canonical SMILES for N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide is COc1ccc(OCC(=O)NNC(=O)c2cccc(OCCc3ccccc3)c2)cc1.
What is the InChIKey of N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide?
The InChIKey is DRPJALJETIXRNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O5/c1-29-20-10-12-21(13-11-20)31-17-23(27)25-26-24(28)19-8-5-9-22(16-19)30-15-14-18-6-3-2-4-7-18/h2-13,16H,14-15,17H2,1H3,(H,25,27)(H,26,28).
What are the key properties of N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide?
N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide has a molecular weight of 420.47 g/mol, XLogP of 3.16, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide is sourced from PubChem (CID 17134452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).