[3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine

C17H19FN2O — CID 105233881

IUPAC[3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine
SMILESCc1cc(F)cc(C(NN)C2CCOc3ccccc32)c1
InChIInChI=1S/C17H19FN2O/c1-11-8-12(10-13(18)9-11)17(20-19)15-6-7-21-16-5-3-2-4-14(15)16/h2-5,8-10,15,17,20H,6-7,19H2,1H3
InChIKeyQKZXETDRVZRANS-UHFFFAOYSA-N
MW286.35 g/mol
LogP3.20
Rot. Bonds3

About [3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine

[3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine (PubChem CID 105233881) has the molecular formula C17H19FN2O and a molecular weight of 286.35 g/mol. Its IUPAC name is [3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine
PubChem CID105233881
Molecular FormulaC17H19FN2O
Molecular Weight286.35 g/mol
Exact Mass286.15
IUPAC Name[3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine
SMILESCc1cc(F)cc(C(NN)C2CCOc3ccccc32)c1
InChIInChI=1S/C17H19FN2O/c1-11-8-12(10-13(18)9-11)17(20-19)15-6-7-21-16-5-3-2-4-14(15)16/h2-5,8-10,15,17,20H,6-7,19H2,1H3
InChIKeyQKZXETDRVZRANS-UHFFFAOYSA-N
XLogP3.20
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 53.20
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

1-(3,4-dihydro-2H-chromen-4-yl)-N-methyl-1-(3-methylphenyl)methanamine
CID 65409875
3,4-dihydro-2H-chromen-4-yl-(4-fluoro-3,5-dimethylphenyl)methanamine
CID 65299189
[3,4-dihydro-2H-chromen-4-yl-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105233771
[(3,5-dimethylphenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
CID 105218933
[1-(3,4-dihydro-2H-chromen-4-yl)-2-(4-fluorophenyl)ethyl]hydrazine
CID 105233739
1-(3-bromo-4-fluorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)-N-methylmethanamine
CID 79723538
[1-(3,4-dihydro-2H-chromen-4-yl)-2-ethylbutyl]hydrazine
CID 105233719
[cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine
CID 105232121
3,4-dihydro-2H-chromen-4-yl-(4-methylphenyl)methanol
CID 63709198
[3,4-dihydro-2H-chromen-4-yl-(4-methylcyclohexyl)methyl]hydrazine
CID 105233829
[2,3-dihydro-1-benzofuran-3-yl-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105262790
[cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine
CID 105233788

Frequently Asked Questions

What is the IUPAC name of [3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The IUPAC name of [3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine (CID 105233881) is [3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The canonical SMILES for [3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine is Cc1cc(F)cc(C(NN)C2CCOc3ccccc32)c1.
What is the InChIKey of [3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The InChIKey is QKZXETDRVZRANS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O/c1-11-8-12(10-13(18)9-11)17(20-19)15-6-7-21-16-5-3-2-4-14(15)16/h2-5,8-10,15,17,20H,6-7,19H2,1H3.
What are the key properties of [3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
[3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine has a molecular weight of 286.35 g/mol, XLogP of 3.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-dihydro-2H-chromen-4-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 105233881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).