N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide

C17H18N2O4 — CID 2870823

IUPACN'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide
SMILESO=C(COc1cccc2ccccc12)NNC(=O)C1CCCO1
InChIInChI=1S/C17H18N2O4/c20-16(18-19-17(21)15-9-4-10-22-15)11-23-14-8-3-6-12-5-1-2-7-13(12)14/h1-3,5-8,15H,4,9-11H2,(H,18,20)(H,19,21)
InChIKeyYNLGEOOSIKTHMM-UHFFFAOYSA-N
MW314.34 g/mol
LogP1.54
Rot. Bonds4

About N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide

N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide (PubChem CID 2870823) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide.

Molecular Properties

Compound NameN'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide
PubChem CID2870823
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC NameN'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide
SMILESO=C(COc1cccc2ccccc12)NNC(=O)C1CCCO1
InChIInChI=1S/C17H18N2O4/c20-16(18-19-17(21)15-9-4-10-22-15)11-23-14-8-3-6-12-5-1-2-7-13(12)14/h1-3,5-8,15H,4,9-11H2,(H,18,20)(H,19,21)
InChIKeyYNLGEOOSIKTHMM-UHFFFAOYSA-N
XLogP1.54
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2,4-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide
CID 2873188
N'-acetyl-2-naphthalen-1-yloxyacetohydrazide
CID 922179
(2R)-N'-[2-(4-chlorophenoxy)acetyl]oxolane-2-carbohydrazide
CID 40562072
(2R)-N'-[2-(4-chloro-2-methylphenoxy)acetyl]oxolane-2-carbohydrazide
CID 774185
2-naphthalen-1-yloxy-N-[2-[(2-naphthalen-1-yloxyacetyl)amino]cyclohexyl]acetamide
CID 5176839
2-[(2-naphthalen-1-yloxyacetyl)amino]-N-(oxolan-2-ylmethyl)benzamide
CID 17361740
N-(cyclohexylmethyl)-2-naphthalen-1-yloxyacetamide
CID 2504525
N-(4-hydroxycyclohexyl)-2-naphthalen-1-yloxyacetamide
CID 112788976
N'-[2-(2-methylphenyl)acetyl]oxolane-2-carbohydrazide
CID 47189407
(2S)-N'-(2-methoxybenzoyl)oxolane-2-carbohydrazide
CID 748723
2-naphthalen-2-yloxy-N'-(2-naphthalen-1-yloxyacetyl)acetohydrazide
CID 4228152
N-[(1S,2R)-2-methylcyclohexyl]-2-naphthalen-1-yloxyacetamide
CID 2504510

Frequently Asked Questions

What is the IUPAC name of N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide?
The IUPAC name of N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide (CID 2870823) is N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide.
What is the SMILES notation for N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide?
The canonical SMILES for N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide is O=C(COc1cccc2ccccc12)NNC(=O)C1CCCO1.
What is the InChIKey of N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide?
The InChIKey is YNLGEOOSIKTHMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c20-16(18-19-17(21)15-9-4-10-22-15)11-23-14-8-3-6-12-5-1-2-7-13(12)14/h1-3,5-8,15H,4,9-11H2,(H,18,20)(H,19,21).
What are the key properties of N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide?
N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide has a molecular weight of 314.34 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-naphthalen-1-yloxyacetyl)oxolane-2-carbohydrazide is sourced from PubChem (CID 2870823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).