cyclopentyl(dipyridin-2-yl)phosphane

C15H17N2P — CID 126497392

IUPACcyclopentyl(dipyridin-2-yl)phosphane
SMILESc1ccc(P(c2ccccn2)C2CCCC2)nc1
InChIInChI=1S/C15H17N2P/c1-2-8-13(7-1)18(14-9-3-5-11-16-14)15-10-4-6-12-17-15/h3-6,9-13H,1-2,7-8H2
InChIKeySHTMJDRCYPHEJX-UHFFFAOYSA-N
MW256.29 g/mol
LogP2.85
Rot. Bonds3

About cyclopentyl(dipyridin-2-yl)phosphane

cyclopentyl(dipyridin-2-yl)phosphane (PubChem CID 126497392) has the molecular formula C15H17N2P and a molecular weight of 256.29 g/mol. Its IUPAC name is cyclopentyl(dipyridin-2-yl)phosphane.

Molecular Properties

Compound Namecyclopentyl(dipyridin-2-yl)phosphane
PubChem CID126497392
Molecular FormulaC15H17N2P
Molecular Weight256.29 g/mol
Exact Mass256.11
IUPAC Namecyclopentyl(dipyridin-2-yl)phosphane
SMILESc1ccc(P(c2ccccn2)C2CCCC2)nc1
InChIInChI=1S/C15H17N2P/c1-2-8-13(7-1)18(14-9-3-5-11-16-14)15-10-4-6-12-17-15/h3-6,9-13H,1-2,7-8H2
InChIKeySHTMJDRCYPHEJX-UHFFFAOYSA-N
XLogP2.85
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.29
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze cyclopentyl(dipyridin-2-yl)phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of cyclopentyl(dipyridin-2-yl)phosphane?
The IUPAC name of cyclopentyl(dipyridin-2-yl)phosphane (CID 126497392) is cyclopentyl(dipyridin-2-yl)phosphane.
What is the SMILES notation for cyclopentyl(dipyridin-2-yl)phosphane?
The canonical SMILES for cyclopentyl(dipyridin-2-yl)phosphane is c1ccc(P(c2ccccn2)C2CCCC2)nc1.
What is the InChIKey of cyclopentyl(dipyridin-2-yl)phosphane?
The InChIKey is SHTMJDRCYPHEJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N2P/c1-2-8-13(7-1)18(14-9-3-5-11-16-14)15-10-4-6-12-17-15/h3-6,9-13H,1-2,7-8H2.
What are the key properties of cyclopentyl(dipyridin-2-yl)phosphane?
cyclopentyl(dipyridin-2-yl)phosphane has a molecular weight of 256.29 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl(dipyridin-2-yl)phosphane is sourced from PubChem (CID 126497392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).