dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane

C24H32NP — CID 59775224

IUPACdicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane
SMILESc1ccc(-c2cccc(CP(C3CCCCC3)C3CCCCC3)n2)cc1
InChIInChI=1S/C24H32NP/c1-4-11-20(12-5-1)24-18-10-13-21(25-24)19-26(22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1,4-5,10-13,18,22-23H,2-3,6-9,14-17,19H2
InChIKeyYGPHYJVLBSMPSH-UHFFFAOYSA-N
MW365.50 g/mol
LogP7.40
Rot. Bonds5

About dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane

dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane (PubChem CID 59775224) has the molecular formula C24H32NP and a molecular weight of 365.50 g/mol. Its IUPAC name is dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane.

Molecular Properties

Compound Namedicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane
PubChem CID59775224
Molecular FormulaC24H32NP
Molecular Weight365.50 g/mol
Exact Mass365.23
IUPAC Namedicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane
SMILESc1ccc(-c2cccc(CP(C3CCCCC3)C3CCCCC3)n2)cc1
InChIInChI=1S/C24H32NP/c1-4-11-20(12-5-1)24-18-10-13-21(25-24)19-26(22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1,4-5,10-13,18,22-23H,2-3,6-9,14-17,19H2
InChIKeyYGPHYJVLBSMPSH-UHFFFAOYSA-N
XLogP7.40
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.50
LogP ≤ 57.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]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 dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane?
The IUPAC name of dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane (CID 59775224) is dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane.
What is the SMILES notation for dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane?
The canonical SMILES for dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane is c1ccc(-c2cccc(CP(C3CCCCC3)C3CCCCC3)n2)cc1.
What is the InChIKey of dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane?
The InChIKey is YGPHYJVLBSMPSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32NP/c1-4-11-20(12-5-1)24-18-10-13-21(25-24)19-26(22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1,4-5,10-13,18,22-23H,2-3,6-9,14-17,19H2.
What are the key properties of dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane?
dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane has a molecular weight of 365.50 g/mol, XLogP of 7.40, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dicyclohexyl-[(6-phenyl-2-pyridinyl)methyl]phosphane is sourced from PubChem (CID 59775224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).