N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide

C11H15F2N3O2 — CID 107486304

IUPACN-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide
SMILESNNc1ccccc1C(=O)N(CCO)CC(F)F
InChIInChI=1S/C11H15F2N3O2/c12-10(13)7-16(5-6-17)11(18)8-3-1-2-4-9(8)15-14/h1-4,10,15,17H,5-7,14H2
InChIKeyKGSIHILKYAZSCL-UHFFFAOYSA-N
MW259.26 g/mol
LogP0.67
Rot. Bonds6

About N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide

N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide (PubChem CID 107486304) has the molecular formula C11H15F2N3O2 and a molecular weight of 259.26 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide
PubChem CID107486304
Molecular FormulaC11H15F2N3O2
Molecular Weight259.26 g/mol
Exact Mass259.11
IUPAC NameN-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide
SMILESNNc1ccccc1C(=O)N(CCO)CC(F)F
InChIInChI=1S/C11H15F2N3O2/c12-10(13)7-16(5-6-17)11(18)8-3-1-2-4-9(8)15-14/h1-4,10,15,17H,5-7,14H2
InChIKeyKGSIHILKYAZSCL-UHFFFAOYSA-N
XLogP0.67
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.26
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(methylamino)benzamide
CID 107481586
5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide
CID 107486316
N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)-3-nitrobenzamide
CID 107486313
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-methoxypyridine-3-carboxamide
CID 107483009
2-hydrazinyl-N,N-bis(3-methylbutyl)benzamide
CID 107871087
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)quinoline-5-carboxamide
CID 107482532
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3-(methylamino)pyridine-4-carboxamide
CID 107486032
2-amino-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3-nitrobenzamide
CID 107485996
N-ethyl-2-hydrazinyl-N-propylbenzamide
CID 62243548
2-amino-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-5-methylbenzamide
CID 107477906
N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)pyridine-4-carboxamide
CID 107486289
N-(2,2-difluoroethyl)-2,3-difluoro-N-(2-hydroxyethyl)pyridine-4-carboxamide
CID 107479235

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide?
The IUPAC name of N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide (CID 107486304) is N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide is NNc1ccccc1C(=O)N(CCO)CC(F)F.
What is the InChIKey of N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide?
The InChIKey is KGSIHILKYAZSCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2N3O2/c12-10(13)7-16(5-6-17)11(18)8-3-1-2-4-9(8)15-14/h1-4,10,15,17H,5-7,14H2.
What are the key properties of N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide?
N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide has a molecular weight of 259.26 g/mol, XLogP of 0.67, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 107486304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).