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

C11H14ClF2N3O2 — CID 107486316

IUPAC5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide
SMILESNNc1ccc(Cl)cc1C(=O)N(CCO)CC(F)F
InChIInChI=1S/C11H14ClF2N3O2/c12-7-1-2-9(16-15)8(5-7)11(19)17(3-4-18)6-10(13)14/h1-2,5,10,16,18H,3-4,6,15H2
InChIKeyPCUTVFCKSWYLJX-UHFFFAOYSA-N
MW293.70 g/mol
LogP1.33
Rot. Bonds6

About 5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide

5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide (PubChem CID 107486316) has the molecular formula C11H14ClF2N3O2 and a molecular weight of 293.70 g/mol. Its IUPAC name is 5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide
PubChem CID107486316
Molecular FormulaC11H14ClF2N3O2
Molecular Weight293.70 g/mol
Exact Mass293.07
IUPAC Name5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide
SMILESNNc1ccc(Cl)cc1C(=O)N(CCO)CC(F)F
InChIInChI=1S/C11H14ClF2N3O2/c12-7-1-2-9(16-15)8(5-7)11(19)17(3-4-18)6-10(13)14/h1-2,5,10,16,18H,3-4,6,15H2
InChIKeyPCUTVFCKSWYLJX-UHFFFAOYSA-N
XLogP1.33
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.70
LogP ≤ 51.33
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

5-chloro-N-ethyl-2-hydrazinyl-N-(2-hydroxyethyl)benzamide
CID 62236604
5-chloro-2-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)benzamide
CID 113468065
2,4-dichloro-N-(2,2-difluoroethyl)-5-fluoro-N-(2-hydroxyethyl)benzamide
CID 107483219
5-chloro-2-fluoro-N,N-bis(2-hydroxyethyl)benzamide
CID 61145588
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-5-methyl-2-(propylamino)benzamide
CID 107486049
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(methylamino)benzamide
CID 107481586
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
5-chloro-2-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 62247658
N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)-3-nitrobenzamide
CID 107486313
N-(2-amino-4-chlorophenyl)-2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide
CID 107478609
N-butan-2-yl-5-chloro-N-ethyl-2-hydrazinylbenzamide
CID 62241178

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide (CID 107486316) is 5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide is NNc1ccc(Cl)cc1C(=O)N(CCO)CC(F)F.
What is the InChIKey of 5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide?
The InChIKey is PCUTVFCKSWYLJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClF2N3O2/c12-7-1-2-9(16-15)8(5-7)11(19)17(3-4-18)6-10(13)14/h1-2,5,10,16,18H,3-4,6,15H2.
What are the key properties of 5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide?
5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide has a molecular weight of 293.70 g/mol, XLogP of 1.33, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 107486316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).