[2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine

C17H19ClN2O — CID 105233880

IUPAC[2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine
SMILESNNC(Cc1cccc(Cl)c1)C1CCOc2ccccc21
InChIInChI=1S/C17H19ClN2O/c18-13-5-3-4-12(10-13)11-16(20-19)14-8-9-21-17-7-2-1-6-15(14)17/h1-7,10,14,16,20H,8-9,11,19H2
InChIKeyKAGHEQCMKMURDV-UHFFFAOYSA-N
MW302.81 g/mol
LogP3.28
Rot. Bonds4

About [2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine

[2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine (PubChem CID 105233880) has the molecular formula C17H19ClN2O and a molecular weight of 302.81 g/mol. Its IUPAC name is [2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine
PubChem CID105233880
Molecular FormulaC17H19ClN2O
Molecular Weight302.81 g/mol
Exact Mass302.12
IUPAC Name[2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine
SMILESNNC(Cc1cccc(Cl)c1)C1CCOc2ccccc21
InChIInChI=1S/C17H19ClN2O/c18-13-5-3-4-12(10-13)11-16(20-19)14-8-9-21-17-7-2-1-6-15(14)17/h1-7,10,14,16,20H,8-9,11,19H2
InChIKeyKAGHEQCMKMURDV-UHFFFAOYSA-N
XLogP3.28
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.81
LogP ≤ 53.28
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)-2-(4-fluorophenyl)ethyl]hydrazine
CID 105233739
[2-(5-chlorothiophen-2-yl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine
CID 105233865
1-(3-chlorophenyl)-3-(3,4-dihydro-2H-chromen-4-yl)propan-2-amine
CID 104770108
2-(4-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)-N-methylethanamine
CID 65411645
[2-(3-chlorophenyl)-1-(2-methyloxolan-3-yl)ethyl]hydrazine
CID 105283424
[1-(3-bicyclo[3.1.0]hexanyl)-2-(3-chlorophenyl)ethyl]hydrazine
CID 105283427
[2-(3-chlorophenyl)-1-cyclobutylethyl]hydrazine
CID 105195049
3-[2-(3,4-dihydro-2H-chromen-4-yl)-2-hydrazinylethyl]pyridin-2-amine
CID 105233874
[1-(3,4-dihydro-2H-chromen-4-yl)-2-propan-2-yloxyethyl]hydrazine
CID 105233876
1-(3,4-dihydro-2H-chromen-4-yl)octylhydrazine
CID 105233759
[1-(3,4-dihydro-2H-chromen-4-yl)-3-methylsulfonylpropyl]hydrazine
CID 114984739
[1-(3,4-dihydro-2H-chromen-4-yl)-4-methoxybutyl]hydrazine
CID 105233846

Frequently Asked Questions

What is the IUPAC name of [2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine?
The IUPAC name of [2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine (CID 105233880) is [2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine?
The canonical SMILES for [2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine is NNC(Cc1cccc(Cl)c1)C1CCOc2ccccc21.
What is the InChIKey of [2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine?
The InChIKey is KAGHEQCMKMURDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O/c18-13-5-3-4-12(10-13)11-16(20-19)14-8-9-21-17-7-2-1-6-15(14)17/h1-7,10,14,16,20H,8-9,11,19H2.
What are the key properties of [2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine?
[2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine has a molecular weight of 302.81 g/mol, XLogP of 3.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-chlorophenyl)-1-(3,4-dihydro-2H-chromen-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105233880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).