diphenyl-propan-2-yl-pyridazin-3-ylphosphanium

C19H20N2P+ — CID 146520331

IUPACdiphenyl-propan-2-yl-pyridazin-3-ylphosphanium
SMILESCC(C)[P+](c1ccccc1)(c1ccccc1)c1cccnn1
InChIInChI=1S/C19H20N2P/c1-16(2)22(17-10-5-3-6-11-17,18-12-7-4-8-13-18)19-14-9-15-20-21-19/h3-16H,1-2H3/q+1
InChIKeyZVLFGRNXKBEHJT-UHFFFAOYSA-N
MW307.36 g/mol
LogP3.18
Rot. Bonds4

About diphenyl-propan-2-yl-pyridazin-3-ylphosphanium

diphenyl-propan-2-yl-pyridazin-3-ylphosphanium (PubChem CID 146520331) has the molecular formula C19H20N2P+ and a molecular weight of 307.36 g/mol. Its IUPAC name is diphenyl-propan-2-yl-pyridazin-3-ylphosphanium.

Molecular Properties

Compound Namediphenyl-propan-2-yl-pyridazin-3-ylphosphanium
PubChem CID146520331
Molecular FormulaC19H20N2P+
Molecular Weight307.36 g/mol
Exact Mass307.14
IUPAC Namediphenyl-propan-2-yl-pyridazin-3-ylphosphanium
SMILESCC(C)[P+](c1ccccc1)(c1ccccc1)c1cccnn1
InChIInChI=1S/C19H20N2P/c1-16(2)22(17-10-5-3-6-11-17,18-12-7-4-8-13-18)19-14-9-15-20-21-19/h3-16H,1-2H3/q+1
InChIKeyZVLFGRNXKBEHJT-UHFFFAOYSA-N
XLogP3.18
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.36
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diphenyl-propan-2-yl-pyridazin-3-ylphosphanium?
The IUPAC name of diphenyl-propan-2-yl-pyridazin-3-ylphosphanium (CID 146520331) is diphenyl-propan-2-yl-pyridazin-3-ylphosphanium.
What is the SMILES notation for diphenyl-propan-2-yl-pyridazin-3-ylphosphanium?
The canonical SMILES for diphenyl-propan-2-yl-pyridazin-3-ylphosphanium is CC(C)[P+](c1ccccc1)(c1ccccc1)c1cccnn1.
What is the InChIKey of diphenyl-propan-2-yl-pyridazin-3-ylphosphanium?
The InChIKey is ZVLFGRNXKBEHJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2P/c1-16(2)22(17-10-5-3-6-11-17,18-12-7-4-8-13-18)19-14-9-15-20-21-19/h3-16H,1-2H3/q+1.
What are the key properties of diphenyl-propan-2-yl-pyridazin-3-ylphosphanium?
diphenyl-propan-2-yl-pyridazin-3-ylphosphanium has a molecular weight of 307.36 g/mol, XLogP of 3.18, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-propan-2-yl-pyridazin-3-ylphosphanium is sourced from PubChem (CID 146520331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).