[2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine

C15H18ClFN2O — CID 107895489

IUPAC[2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
SMILESCc1oc(C)c(C(Cc2ccc(Cl)c(F)c2)NN)c1C
InChIInChI=1S/C15H18ClFN2O/c1-8-9(2)20-10(3)15(8)14(19-18)7-11-4-5-12(16)13(17)6-11/h4-6,14,19H,7,18H2,1-3H3
InChIKeyQCMUTPLPSCFGKR-UHFFFAOYSA-N
MW296.77 g/mol
LogP3.74
Rot. Bonds4

About [2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine

[2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine (PubChem CID 107895489) has the molecular formula C15H18ClFN2O and a molecular weight of 296.77 g/mol. Its IUPAC name is [2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
PubChem CID107895489
Molecular FormulaC15H18ClFN2O
Molecular Weight296.77 g/mol
Exact Mass296.11
IUPAC Name[2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
SMILESCc1oc(C)c(C(Cc2ccc(Cl)c(F)c2)NN)c1C
InChIInChI=1S/C15H18ClFN2O/c1-8-9(2)20-10(3)15(8)14(19-18)7-11-4-5-12(16)13(17)6-11/h4-6,14,19H,7,18H2,1-3H3
InChIKeyQCMUTPLPSCFGKR-UHFFFAOYSA-N
XLogP3.74
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.77
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[2-(4-chloro-3-fluorophenyl)-1-(2,6-dichlorophenyl)ethyl]hydrazine
CID 107895613
[2-(4-chloro-3-fluorophenyl)-1-(4-methylphenyl)ethyl]hydrazine
CID 114013667
[2-phenyl-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105283083
[2-(2-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105332792
[2-(4-chloro-3-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 107895230
[2-(4-chloro-3-fluorophenyl)-1-(2,4-dichlorophenyl)ethyl]hydrazine
CID 107895525
[2-(4-chloro-3-fluorophenyl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
CID 114013717
[2-(4-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethyl]hydrazine
CID 107895008
[2-(4-chloro-3-fluorophenyl)-1-(2,5-difluorophenyl)ethyl]hydrazine
CID 107895012
[2-(4-chloro-3-fluorophenyl)-1-(2,4-difluorophenyl)ethyl]hydrazine
CID 107894963
[2-(4-chloro-3-fluorophenyl)-1-(4-methoxyphenyl)ethyl]hydrazine
CID 107894760
[2-(3,4-dichlorophenyl)-1-(2,6-difluorophenyl)ethyl]hydrazine
CID 105210798

Frequently Asked Questions

What is the IUPAC name of [2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine (CID 107895489) is [2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine is Cc1oc(C)c(C(Cc2ccc(Cl)c(F)c2)NN)c1C.
What is the InChIKey of [2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine?
The InChIKey is QCMUTPLPSCFGKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClFN2O/c1-8-9(2)20-10(3)15(8)14(19-18)7-11-4-5-12(16)13(17)6-11/h4-6,14,19H,7,18H2,1-3H3.
What are the key properties of [2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine?
[2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine has a molecular weight of 296.77 g/mol, XLogP of 3.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine is sourced from PubChem (CID 107895489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).