[1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine

C17H21FN2 — CID 105198260

IUPAC[1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine
SMILESCc1cc(C)cc(CC(Cc2ccc(F)cc2)NN)c1
InChIInChI=1S/C17H21FN2/c1-12-7-13(2)9-15(8-12)11-17(20-19)10-14-3-5-16(18)6-4-14/h3-9,17,20H,10-11,19H2,1-2H3
InChIKeyQXXNZUAPLICICM-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.06
Rot. Bonds5

About [1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine

[1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine (PubChem CID 105198260) has the molecular formula C17H21FN2 and a molecular weight of 272.37 g/mol. Its IUPAC name is [1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine
PubChem CID105198260
Molecular FormulaC17H21FN2
Molecular Weight272.37 g/mol
Exact Mass272.17
IUPAC Name[1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine
SMILESCc1cc(C)cc(CC(Cc2ccc(F)cc2)NN)c1
InChIInChI=1S/C17H21FN2/c1-12-7-13(2)9-15(8-12)11-17(20-19)10-14-3-5-16(18)6-4-14/h3-9,17,20H,10-11,19H2,1-2H3
InChIKeyQXXNZUAPLICICM-UHFFFAOYSA-N
XLogP3.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

[1-(2-chloro-4-fluorophenyl)-3-(3,5-dimethylphenyl)propan-2-yl]hydrazine
CID 105212582
[1-(3,5-dimethylphenyl)-3-(3-methylphenyl)propan-2-yl]hydrazine
CID 105208894
[1-(3-bromo-5-fluorophenyl)-3-(4-methylphenyl)propan-2-yl]hydrazine
CID 105211313
[1-(3,5-dimethylphenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
CID 105205945
[1-(4-fluorophenyl)-3-(3-methoxyphenyl)propan-2-yl]hydrazine
CID 105198413
[1-(2-chloro-3-fluorophenyl)-3-(3,5-dimethylphenyl)propan-2-yl]hydrazine
CID 105212595
[1-(2,6-difluorophenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine
CID 105198434
[1-(3,5-dimethylphenyl)-3-(5-ethyl-2-pyridinyl)propan-2-yl]hydrazine
CID 105212613
[1-tert-butylsulfanyl-3-(4-fluorophenyl)propan-2-yl]hydrazine
CID 105226349
1-(3,5-dimethylphenyl)-2-(4-fluorophenyl)ethanol
CID 60918138
[1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine
CID 105198284
1,3-bis(3,4-dimethylphenyl)propan-2-ylhydrazine
CID 105215161

Frequently Asked Questions

What is the IUPAC name of [1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine (CID 105198260) is [1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine is Cc1cc(C)cc(CC(Cc2ccc(F)cc2)NN)c1.
What is the InChIKey of [1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine?
The InChIKey is QXXNZUAPLICICM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2/c1-12-7-13(2)9-15(8-12)11-17(20-19)10-14-3-5-16(18)6-4-14/h3-9,17,20H,10-11,19H2,1-2H3.
What are the key properties of [1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine?
[1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine has a molecular weight of 272.37 g/mol, XLogP of 3.06, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,5-dimethylphenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105198260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).