[3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine

C17H19FN2O — CID 105257545

IUPAC[3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine
SMILESCc1cc(F)cc(C(NN)c2cccc3c2OCCC3)c1
InChIInChI=1S/C17H19FN2O/c1-11-8-13(10-14(18)9-11)16(20-19)15-6-2-4-12-5-3-7-21-17(12)15/h2,4,6,8-10,16,20H,3,5,7,19H2,1H3
InChIKeyLWVDHLOBFWLVLG-UHFFFAOYSA-N
MW286.35 g/mol
LogP3.01
Rot. Bonds3

About [3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine

[3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine (PubChem CID 105257545) has the molecular formula C17H19FN2O and a molecular weight of 286.35 g/mol. Its IUPAC name is [3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine
PubChem CID105257545
Molecular FormulaC17H19FN2O
Molecular Weight286.35 g/mol
Exact Mass286.15
IUPAC Name[3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine
SMILESCc1cc(F)cc(C(NN)c2cccc3c2OCCC3)c1
InChIInChI=1S/C17H19FN2O/c1-11-8-13(10-14(18)9-11)16(20-19)15-6-2-4-12-5-3-7-21-17(12)15/h2,4,6,8-10,16,20H,3,5,7,19H2,1H3
InChIKeyLWVDHLOBFWLVLG-UHFFFAOYSA-N
XLogP3.01
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 ≤ 53.01
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

[3,4-dihydro-2H-chromen-8-yl-(3-fluoro-4-methylphenyl)methyl]hydrazine
CID 105201665
[(3-bromo-5-fluorophenyl)-(2,3-dihydro-1-benzofuran-7-yl)methyl]hydrazine
CID 105238803
[(3-bromo-5-chlorophenyl)-(3,4-dihydro-2H-chromen-8-yl)methyl]hydrazine
CID 107948543
[2,3-dihydro-1-benzofuran-7-yl-(4-fluoro-3-methylphenyl)methyl]hydrazine
CID 105204228
[(3-chloro-4-iodophenyl)-(3,4-dihydro-2H-chromen-8-yl)methyl]hydrazine
CID 103217817
[3,4-dihydro-2H-chromen-8-yl-(2-ethylphenyl)methyl]hydrazine
CID 105340021
1-(2-bromo-5-fluorophenyl)-1-(3,4-dihydro-2H-chromen-8-yl)-N-methylmethanamine
CID 105049062
N-[2,3-dihydro-1-benzofuran-7-yl-(3,5-dimethylphenyl)methyl]ethanamine
CID 105053520
1-(2-bromo-4-fluorophenyl)-1-(3,4-dihydro-2H-chromen-8-yl)-N-methylmethanamine
CID 105049275
N-[3,4-dihydro-2H-chromen-8-yl-(4-methylphenyl)methyl]ethanamine
CID 114744929
[(5-bromothiophen-3-yl)-(2,3-dihydro-1-benzofuran-7-yl)methyl]hydrazine
CID 105341897
[(2-bromo-4-fluorophenyl)-(2,3-dihydro-1-benzofuran-7-yl)methyl]hydrazine
CID 105341826

Frequently Asked Questions

What is the IUPAC name of [3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The IUPAC name of [3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine (CID 105257545) is [3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The canonical SMILES for [3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine is Cc1cc(F)cc(C(NN)c2cccc3c2OCCC3)c1.
What is the InChIKey of [3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The InChIKey is LWVDHLOBFWLVLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O/c1-11-8-13(10-14(18)9-11)16(20-19)15-6-2-4-12-5-3-7-21-17(12)15/h2,4,6,8-10,16,20H,3,5,7,19H2,1H3.
What are the key properties of [3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
[3,4-dihydro-2H-chromen-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine has a molecular weight of 286.35 g/mol, XLogP of 3.01, 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-8-yl-(3-fluoro-5-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 105257545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).