2-pentoxy-N'-(2-phenylacetyl)benzohydrazide

C20H24N2O3 — CID 4946811

IUPAC2-pentoxy-N'-(2-phenylacetyl)benzohydrazide
SMILESCCCCCOc1ccccc1C(=O)NNC(=O)Cc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-2-3-9-14-25-18-13-8-7-12-17(18)20(24)22-21-19(23)15-16-10-5-4-6-11-16/h4-8,10-13H,2-3,9,14-15H2,1H3,(H,21,23)(H,22,24)
InChIKeyAFDZCTIBLCMOIN-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.26
Rot. Bonds8

About 2-pentoxy-N'-(2-phenylacetyl)benzohydrazide

2-pentoxy-N'-(2-phenylacetyl)benzohydrazide (PubChem CID 4946811) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-pentoxy-N'-(2-phenylacetyl)benzohydrazide.

Molecular Properties

Compound Name2-pentoxy-N'-(2-phenylacetyl)benzohydrazide
PubChem CID4946811
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-pentoxy-N'-(2-phenylacetyl)benzohydrazide
SMILESCCCCCOc1ccccc1C(=O)NNC(=O)Cc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-2-3-9-14-25-18-13-8-7-12-17(18)20(24)22-21-19(23)15-16-10-5-4-6-11-16/h4-8,10-13H,2-3,9,14-15H2,1H3,(H,21,23)(H,22,24)
InChIKeyAFDZCTIBLCMOIN-UHFFFAOYSA-N
XLogP3.26
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-hexoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
CID 4942269
2-butoxy-N'-(2-phenylmethoxybenzoyl)benzohydrazide
CID 4941310
2-butoxy-N-[[(2-phenylacetyl)amino]carbamothioyl]benzamide
CID 4941755
N'-hexanoyl-2-(2-phenoxyethoxy)benzohydrazide
CID 4955613
N'-[2-(4-methoxyphenoxy)acetyl]-2-pentoxybenzohydrazide
CID 4946756
2-propoxy-N'-(2-propoxybenzoyl)benzohydrazide
CID 4948435
2-hexoxy-N'-[2-(4-methylphenoxy)acetyl]benzohydrazide
CID 4942278
2-pentoxybenzohydrazide
CID 54793215
2-butoxy-N'-[2-(4-ethylphenoxy)acetyl]benzohydrazide
CID 4941258
2-pentoxy-N-[(3-phenylpropanoylamino)carbamothioyl]benzamide
CID 4947301
N-hydroxy-2-tetradecoxybenzamide
CID 18962633
3-bromo-4-hexoxy-N'-(2-phenylacetyl)benzohydrazide
CID 4959610

Frequently Asked Questions

What is the IUPAC name of 2-pentoxy-N'-(2-phenylacetyl)benzohydrazide?
The IUPAC name of 2-pentoxy-N'-(2-phenylacetyl)benzohydrazide (CID 4946811) is 2-pentoxy-N'-(2-phenylacetyl)benzohydrazide.
What is the SMILES notation for 2-pentoxy-N'-(2-phenylacetyl)benzohydrazide?
The canonical SMILES for 2-pentoxy-N'-(2-phenylacetyl)benzohydrazide is CCCCCOc1ccccc1C(=O)NNC(=O)Cc1ccccc1.
What is the InChIKey of 2-pentoxy-N'-(2-phenylacetyl)benzohydrazide?
The InChIKey is AFDZCTIBLCMOIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-2-3-9-14-25-18-13-8-7-12-17(18)20(24)22-21-19(23)15-16-10-5-4-6-11-16/h4-8,10-13H,2-3,9,14-15H2,1H3,(H,21,23)(H,22,24).
What are the key properties of 2-pentoxy-N'-(2-phenylacetyl)benzohydrazide?
2-pentoxy-N'-(2-phenylacetyl)benzohydrazide has a molecular weight of 340.42 g/mol, XLogP of 3.26, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pentoxy-N'-(2-phenylacetyl)benzohydrazide is sourced from PubChem (CID 4946811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).