[2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine

C16H16ClFN2O — CID 105262591

IUPAC[2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine
SMILESNNC(Cc1ccc(F)cc1Cl)C1COc2ccccc21
InChIInChI=1S/C16H16ClFN2O/c17-14-8-11(18)6-5-10(14)7-15(20-19)13-9-21-16-4-2-1-3-12(13)16/h1-6,8,13,15,20H,7,9,19H2
InChIKeyNPAZMQLZDSJWGQ-UHFFFAOYSA-N
MW306.77 g/mol
LogP3.03
Rot. Bonds4

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

[2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine (PubChem CID 105262591) has the molecular formula C16H16ClFN2O and a molecular weight of 306.77 g/mol. Its IUPAC name is [2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine
PubChem CID105262591
Molecular FormulaC16H16ClFN2O
Molecular Weight306.77 g/mol
Exact Mass306.09
IUPAC Name[2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine
SMILESNNC(Cc1ccc(F)cc1Cl)C1COc2ccccc21
InChIInChI=1S/C16H16ClFN2O/c17-14-8-11(18)6-5-10(14)7-15(20-19)13-9-21-16-4-2-1-3-12(13)16/h1-6,8,13,15,20H,7,9,19H2
InChIKeyNPAZMQLZDSJWGQ-UHFFFAOYSA-N
XLogP3.03
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.77
LogP ≤ 53.03
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-(2,4-difluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine
CID 105262757
[2-(3-chloro-2-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine
CID 102868102
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-2-(2-chloro-4-fluorophenyl)ethyl]hydrazine
CID 105224610
[2-(3,5-difluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine
CID 105412991
2-(2-chloro-4-fluorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethanol
CID 65409768
2-(4-chloro-3-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)-N-methylethanamine
CID 107885094
[1-(2,3-dihydro-1-benzofuran-3-yl)-4,4,4-trifluorobutyl]hydrazine
CID 105262588
[1-(2,3-dihydro-1-benzofuran-3-yl)-2-(2,5-dimethylpyrazol-3-yl)ethyl]hydrazine
CID 105262730
[1-(3,4-dihydro-2H-chromen-4-yl)-2-(4-fluorophenyl)ethyl]hydrazine
CID 105233739
[1-(2,3-dihydro-1-benzofuran-3-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethyl]hydrazine
CID 105262756
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
CID 105224818
[1-(2,3-dihydro-1-benzofuran-3-yl)-5,5-dimethylhex-3-ynyl]hydrazine
CID 114190772

Frequently Asked Questions

What is the IUPAC name of [2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine (CID 105262591) is [2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine is NNC(Cc1ccc(F)cc1Cl)C1COc2ccccc21.
What is the InChIKey of [2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine?
The InChIKey is NPAZMQLZDSJWGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClFN2O/c17-14-8-11(18)6-5-10(14)7-15(20-19)13-9-21-16-4-2-1-3-12(13)16/h1-6,8,13,15,20H,7,9,19H2.
What are the key properties of [2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine?
[2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine has a molecular weight of 306.77 g/mol, XLogP of 3.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chloro-4-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105262591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).