(2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide

C25H26N2O3 — CID 7978392

IUPAC(2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide
SMILESCCCC(C(=O)NNC(=O)COc1ccccc1-c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O3/c1-2-11-22(20-14-7-4-8-15-20)25(29)27-26-24(28)18-30-23-17-10-9-16-21(23)19-12-5-3-6-13-19/h3-10,12-17,22H,2,11,18H2,1H3,(H,26,28)(H,27,29)
InChIKeyCJNUQRXSFBBCGX-UHFFFAOYSA-N
MW402.49 g/mol
LogP4.46
Rot. Bonds8

About (2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide

(2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide (PubChem CID 7978392) has the molecular formula C25H26N2O3 and a molecular weight of 402.49 g/mol. Its IUPAC name is (2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide.

Molecular Properties

Compound Name(2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide
PubChem CID7978392
Molecular FormulaC25H26N2O3
Molecular Weight402.49 g/mol
Exact Mass402.19
IUPAC Name(2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide
SMILESCCCC(C(=O)NNC(=O)COc1ccccc1-c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O3/c1-2-11-22(20-14-7-4-8-15-20)25(29)27-26-24(28)18-30-23-17-10-9-16-21(23)19-12-5-3-6-13-19/h3-10,12-17,22H,2,11,18H2,1H3,(H,26,28)(H,27,29)
InChIKeyCJNUQRXSFBBCGX-UHFFFAOYSA-N
XLogP4.46
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.49
LogP ≤ 54.46
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

2-methyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide
CID 78771942
(2S)-N'-[2-(2-methylphenoxy)acetyl]-2-phenylpentanehydrazide
CID 9470073
N'-[2-(2-cyanophenoxy)acetyl]-2-phenylpentanehydrazide
CID 78610851
N'-acetyl-2-(2-phenylphenoxy)acetohydrazide
CID 922584
3-methyl-N'-[2-(2-phenylphenoxy)acetyl]butanehydrazide
CID 9470420
2-phenoxy-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide
CID 4940008
2-(2-methylphenoxy)-N'-[2-(2-phenylphenoxy)acetyl]acetohydrazide
CID 5089372
[(2S,3S)-3-methyl-1-oxo-1-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]pentan-2-yl]urea
CID 7613261
2-(2-phenylphenoxy)-N-propylacetamide
CID 112788813
methyl N-[4-methyl-1-oxo-1-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]pentan-2-yl]carbamate
CID 47985288
3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide
CID 55786556
1-N',4-N'-bis[2-(2-phenylphenoxy)acetyl]benzene-1,4-dicarbohydrazide
CID 3554709

Frequently Asked Questions

What is the IUPAC name of (2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide?
The IUPAC name of (2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide (CID 7978392) is (2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide.
What is the SMILES notation for (2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide?
The canonical SMILES for (2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide is CCCC(C(=O)NNC(=O)COc1ccccc1-c1ccccc1)c1ccccc1.
What is the InChIKey of (2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide?
The InChIKey is CJNUQRXSFBBCGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O3/c1-2-11-22(20-14-7-4-8-15-20)25(29)27-26-24(28)18-30-23-17-10-9-16-21(23)19-12-5-3-6-13-19/h3-10,12-17,22H,2,11,18H2,1H3,(H,26,28)(H,27,29).
What are the key properties of (2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide?
(2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide has a molecular weight of 402.49 g/mol, XLogP of 4.46, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-phenyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide is sourced from PubChem (CID 7978392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).