2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol

C13H12ClFN2O — CID 124633762

IUPAC2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol
SMILESNN[C@H](c1ccc(Cl)cc1)c1cc(F)ccc1O
InChIInChI=1S/C13H12ClFN2O/c14-9-3-1-8(2-4-9)13(17-16)11-7-10(15)5-6-12(11)18/h1-7,13,17-18H,16H2/t13-/m1/s1
InChIKeyLFVXNHKWGPVQJW-CYBMUJFWSA-N
MW266.70 g/mol
LogP2.74
Rot. Bonds3

About 2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol

2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol (PubChem CID 124633762) has the molecular formula C13H12ClFN2O and a molecular weight of 266.70 g/mol. Its IUPAC name is 2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol.

Molecular Properties

Compound Name2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol
PubChem CID124633762
Molecular FormulaC13H12ClFN2O
Molecular Weight266.70 g/mol
Exact Mass266.06
IUPAC Name2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol
SMILESNN[C@H](c1ccc(Cl)cc1)c1cc(F)ccc1O
InChIInChI=1S/C13H12ClFN2O/c14-9-3-1-8(2-4-9)13(17-16)11-7-10(15)5-6-12(11)18/h1-7,13,17-18H,16H2/t13-/m1/s1
InChIKeyLFVXNHKWGPVQJW-CYBMUJFWSA-N
XLogP2.74
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.70
LogP ≤ 52.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(2,5-difluorophenyl)-(4-fluorophenyl)methyl]hydrazine
CID 105192702
[(4-chlorophenyl)-[5-fluoro-2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105257620
[(4-chlorophenyl)-(4-fluorophenyl)methyl]hydrazine
CID 105192695
[(2-chloro-5-fluorophenyl)-(4-chloro-3-fluorophenyl)methyl]hydrazine
CID 114025680
[(3-chloro-4-fluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine
CID 105218162
[(3-bromo-4-chlorophenyl)-(2,5-difluorophenyl)methyl]hydrazine
CID 105260967
4-fluoro-2-(1-hydrazinylethyl)phenol
CID 53402356
[(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine
CID 105280098
[(3,5-dichlorophenyl)-(2,4-difluorophenyl)methyl]hydrazine
CID 105303210
[(2-chloro-5-fluorophenyl)-pyridin-4-ylmethyl]hydrazine
CID 105397743
N-[(4-chlorophenyl)-(5-fluoro-2-hydroxyphenyl)methyl]-5-fluoro-6-methylpyridine-2-carboxamide
CID 176599294
[(4-chlorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105193316

Frequently Asked Questions

What is the IUPAC name of 2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol?
The IUPAC name of 2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol (CID 124633762) is 2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol.
What is the SMILES notation for 2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol?
The canonical SMILES for 2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol is NN[C@H](c1ccc(Cl)cc1)c1cc(F)ccc1O.
What is the InChIKey of 2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol?
The InChIKey is LFVXNHKWGPVQJW-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H12ClFN2O/c14-9-3-1-8(2-4-9)13(17-16)11-7-10(15)5-6-12(11)18/h1-7,13,17-18H,16H2/t13-/m1/s1.
What are the key properties of 2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol?
2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol has a molecular weight of 266.70 g/mol, XLogP of 2.74, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(R)-(4-chlorophenyl)-hydrazinylmethyl]-4-fluorophenol is sourced from PubChem (CID 124633762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).