2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide

C14H11F3N2O2 — CID 905420

IUPAC2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide
SMILESO=C(Cc1cccc2ccccc12)NNC(=O)C(F)(F)F
InChIInChI=1S/C14H11F3N2O2/c15-14(16,17)13(21)19-18-12(20)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,18,20)(H,19,21)
InChIKeyLOUHPZRWBGDODH-UHFFFAOYSA-N
MW296.25 g/mol
LogP2.09
Rot. Bonds2

About 2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide

2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide (PubChem CID 905420) has the molecular formula C14H11F3N2O2 and a molecular weight of 296.25 g/mol. Its IUPAC name is 2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide.

Molecular Properties

Compound Name2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide
PubChem CID905420
Molecular FormulaC14H11F3N2O2
Molecular Weight296.25 g/mol
Exact Mass296.08
IUPAC Name2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide
SMILESO=C(Cc1cccc2ccccc12)NNC(=O)C(F)(F)F
InChIInChI=1S/C14H11F3N2O2/c15-14(16,17)13(21)19-18-12(20)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,18,20)(H,19,21)
InChIKeyLOUHPZRWBGDODH-UHFFFAOYSA-N
XLogP2.09
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.25
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(4-chlorophenyl)-N'-(2-naphthalen-1-ylacetyl)acetohydrazide
CID 4936833
4-[2-(2-naphthalen-1-ylacetyl)hydrazinyl]-4-oxobutanoate
CID 7948453
cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide
CID 42386223
N'-(2-naphthalen-1-ylacetyl)pyridine-4-carbohydrazide
CID 4807892
4-chloro-N'-(2-naphthalen-1-ylacetyl)benzohydrazide
CID 3396166
N'-[2-(1-bromonaphthalen-2-yl)oxyacetyl]-2,2,2-trifluoroacetohydrazide
CID 3955420
2,4-difluoro-N'-(2-naphthalen-1-ylacetyl)benzohydrazide
CID 42386169
1-(4-fluorophenyl)-3-[(2-naphthalen-1-ylacetyl)amino]thiourea
CID 9469486
3,5-dimethyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide
CID 42386156
2-fluoro-N-(naphthalen-1-ylmethyl)acetamide
CID 141003098
trimethyl-[(2-naphthalen-1-ylacetyl)amino]azanium
CID 872172
2,2,2-trifluoro-N-(2-hydroxy-2-methyl-3-naphthalen-1-ylpropyl)acetamide
CID 87160915

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide?
The IUPAC name of 2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide (CID 905420) is 2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide.
What is the SMILES notation for 2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide?
The canonical SMILES for 2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide is O=C(Cc1cccc2ccccc12)NNC(=O)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide?
The InChIKey is LOUHPZRWBGDODH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N2O2/c15-14(16,17)13(21)19-18-12(20)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,18,20)(H,19,21).
What are the key properties of 2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide?
2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide has a molecular weight of 296.25 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide is sourced from PubChem (CID 905420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).