[1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine

C15H20N4O — CID 103026194

IUPAC[1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
SMILESCn1nccc1CCC(NN)c1ccc2c(c1)COC2
InChIInChI=1S/C15H20N4O/c1-19-14(6-7-17-19)4-5-15(18-16)11-2-3-12-9-20-10-13(12)8-11/h2-3,6-8,15,18H,4-5,9-10,16H2,1H3
InChIKeyNJCQATPWWUELQF-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.59
Rot. Bonds5

About [1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine

[1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine (PubChem CID 103026194) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is [1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
PubChem CID103026194
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name[1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
SMILESCn1nccc1CCC(NN)c1ccc2c(c1)COC2
InChIInChI=1S/C15H20N4O/c1-19-14(6-7-17-19)4-5-15(18-16)11-2-3-12-9-20-10-13(12)8-11/h2-3,6-8,15,18H,4-5,9-10,16H2,1H3
InChIKeyNJCQATPWWUELQF-UHFFFAOYSA-N
XLogP1.59
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 [1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The IUPAC name of [1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine (CID 103026194) is [1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine.
What is the SMILES notation for [1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The canonical SMILES for [1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine is Cn1nccc1CCC(NN)c1ccc2c(c1)COC2.
What is the InChIKey of [1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The InChIKey is NJCQATPWWUELQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-19-14(6-7-17-19)4-5-15(18-16)11-2-3-12-9-20-10-13(12)8-11/h2-3,6-8,15,18H,4-5,9-10,16H2,1H3.
What are the key properties of [1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
[1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine has a molecular weight of 272.35 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-dihydro-2-benzofuran-5-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine is sourced from PubChem (CID 103026194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).