[3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine

C15H20N4O2 — CID 105233842

IUPAC[3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
SMILESCOc1cnn(C)c1C(NN)C1CCOc2ccccc21
InChIInChI=1S/C15H20N4O2/c1-19-15(13(20-2)9-17-19)14(18-16)11-7-8-21-12-6-4-3-5-10(11)12/h3-6,9,11,14,18H,7-8,16H2,1-2H3
InChIKeyRMXKXZCNXDBCAB-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.50
Rot. Bonds4

About [3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine

[3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine (PubChem CID 105233842) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is [3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
PubChem CID105233842
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name[3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
SMILESCOc1cnn(C)c1C(NN)C1CCOc2ccccc21
InChIInChI=1S/C15H20N4O2/c1-19-15(13(20-2)9-17-19)14(18-16)11-7-8-21-12-6-4-3-5-10(11)12/h3-6,9,11,14,18H,7-8,16H2,1-2H3
InChIKeyRMXKXZCNXDBCAB-UHFFFAOYSA-N
XLogP1.50
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The IUPAC name of [3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine (CID 105233842) is [3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The canonical SMILES for [3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine is COc1cnn(C)c1C(NN)C1CCOc2ccccc21.
What is the InChIKey of [3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The InChIKey is RMXKXZCNXDBCAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-19-15(13(20-2)9-17-19)14(18-16)11-7-8-21-12-6-4-3-5-10(11)12/h3-6,9,11,14,18H,7-8,16H2,1-2H3.
What are the key properties of [3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
[3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine has a molecular weight of 288.35 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105233842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).