N'-(2-phenylacetyl)octanehydrazide

C16H24N2O2 — CID 2166777

IUPACN'-(2-phenylacetyl)octanehydrazide
SMILESCCCCCCCC(=O)NNC(=O)Cc1ccccc1
InChIInChI=1S/C16H24N2O2/c1-2-3-4-5-9-12-15(19)17-18-16(20)13-14-10-7-6-8-11-14/h6-8,10-11H,2-5,9,12-13H2,1H3,(H,17,19)(H,18,20)
InChIKeyUNQQHCKTFJXLKH-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.74
Rot. Bonds8

About N'-(2-phenylacetyl)octanehydrazide

N'-(2-phenylacetyl)octanehydrazide (PubChem CID 2166777) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N'-(2-phenylacetyl)octanehydrazide.

Molecular Properties

Compound NameN'-(2-phenylacetyl)octanehydrazide
PubChem CID2166777
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN'-(2-phenylacetyl)octanehydrazide
SMILESCCCCCCCC(=O)NNC(=O)Cc1ccccc1
InChIInChI=1S/C16H24N2O2/c1-2-3-4-5-9-12-15(19)17-18-16(20)13-14-10-7-6-8-11-14/h6-8,10-11H,2-5,9,12-13H2,1H3,(H,17,19)(H,18,20)
InChIKeyUNQQHCKTFJXLKH-UHFFFAOYSA-N
XLogP2.74
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of N'-(2-phenylacetyl)octanehydrazide?
The IUPAC name of N'-(2-phenylacetyl)octanehydrazide (CID 2166777) is N'-(2-phenylacetyl)octanehydrazide.
What is the SMILES notation for N'-(2-phenylacetyl)octanehydrazide?
The canonical SMILES for N'-(2-phenylacetyl)octanehydrazide is CCCCCCCC(=O)NNC(=O)Cc1ccccc1.
What is the InChIKey of N'-(2-phenylacetyl)octanehydrazide?
The InChIKey is UNQQHCKTFJXLKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-2-3-4-5-9-12-15(19)17-18-16(20)13-14-10-7-6-8-11-14/h6-8,10-11H,2-5,9,12-13H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N'-(2-phenylacetyl)octanehydrazide?
N'-(2-phenylacetyl)octanehydrazide has a molecular weight of 276.38 g/mol, XLogP of 2.74, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-phenylacetyl)octanehydrazide is sourced from PubChem (CID 2166777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).