[(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine

C14H12ClF3N2 — CID 107131089

IUPAC[(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2cc(F)c(Cl)cc2F)cc1F
InChIInChI=1S/C14H12ClF3N2/c1-7-2-3-8(4-11(7)16)14(20-19)9-5-13(18)10(15)6-12(9)17/h2-6,14,20H,19H2,1H3
InChIKeyNCOJZTDNKVJRPO-UHFFFAOYSA-N
MW300.71 g/mol
LogP3.62
Rot. Bonds3

About [(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine

[(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine (PubChem CID 107131089) has the molecular formula C14H12ClF3N2 and a molecular weight of 300.71 g/mol. Its IUPAC name is [(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
PubChem CID107131089
Molecular FormulaC14H12ClF3N2
Molecular Weight300.71 g/mol
Exact Mass300.06
IUPAC Name[(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2cc(F)c(Cl)cc2F)cc1F
InChIInChI=1S/C14H12ClF3N2/c1-7-2-3-8(4-11(7)16)14(20-19)9-5-13(18)10(15)6-12(9)17/h2-6,14,20H,19H2,1H3
InChIKeyNCOJZTDNKVJRPO-UHFFFAOYSA-N
XLogP3.62
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.71
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(2,4-difluoro-5-methylphenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
CID 107131008
[(4-chloro-3-fluorophenyl)-(2,3-difluoro-4-methylphenyl)methyl]hydrazine
CID 107997445
[(4-chloro-2,5-difluorophenyl)-(6-methyl-3-pyridinyl)methyl]hydrazine
CID 105305537
[(2-bromo-4-chlorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
CID 114025685
[(3-fluoro-4-methylphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105201418
[(3-fluoro-4-methylphenyl)-(4-fluoro-3-methylphenyl)methyl]hydrazine
CID 105201447
N-[(4-chloro-2,5-difluorophenyl)-(3-chloro-4-methylphenyl)methyl]ethanamine
CID 107561868
[(4-chloro-2-fluorophenyl)-(4-chloro-3-methylphenyl)methyl]hydrazine
CID 105328366
[(2-bromo-5-fluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
CID 107131075
[(3-fluoro-4-methylphenyl)-(2-methoxyphenyl)methyl]hydrazine
CID 105201411
[(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine
CID 107130966
[(2-chloro-5-fluorophenyl)-(4-chloro-3-fluorophenyl)methyl]hydrazine
CID 114025680

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine?
The IUPAC name of [(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine (CID 107131089) is [(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine is Cc1ccc(C(NN)c2cc(F)c(Cl)cc2F)cc1F.
What is the InChIKey of [(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine?
The InChIKey is NCOJZTDNKVJRPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClF3N2/c1-7-2-3-8(4-11(7)16)14(20-19)9-5-13(18)10(15)6-12(9)17/h2-6,14,20H,19H2,1H3.
What are the key properties of [(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine?
[(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine has a molecular weight of 300.71 g/mol, XLogP of 3.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-2,5-difluorophenyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 107131089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).