cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane

C19H35P — CID 59045194

IUPACcyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane
SMILESCC1CCCC1CP(CC1CCCC1C)C1CCCC1
InChIInChI=1S/C19H35P/c1-15-7-5-9-17(15)13-20(19-11-3-4-12-19)14-18-10-6-8-16(18)2/h15-19H,3-14H2,1-2H3
InChIKeyXPPYPOARSMIGBO-UHFFFAOYSA-N
MW294.46 g/mol
LogP6.28
Rot. Bonds5

About cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane

cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane (PubChem CID 59045194) has the molecular formula C19H35P and a molecular weight of 294.46 g/mol. Its IUPAC name is cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane.

Molecular Properties

Compound Namecyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane
PubChem CID59045194
Molecular FormulaC19H35P
Molecular Weight294.46 g/mol
Exact Mass294.25
IUPAC Namecyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane
SMILESCC1CCCC1CP(CC1CCCC1C)C1CCCC1
InChIInChI=1S/C19H35P/c1-15-7-5-9-17(15)13-20(19-11-3-4-12-19)14-18-10-6-8-16(18)2/h15-19H,3-14H2,1-2H3
InChIKeyXPPYPOARSMIGBO-UHFFFAOYSA-N
XLogP6.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.46
LogP ≤ 56.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze cyclopentyl-bis[(2-methylcyclopentyl)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 cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane?
The IUPAC name of cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane (CID 59045194) is cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane.
What is the SMILES notation for cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane?
The canonical SMILES for cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane is CC1CCCC1CP(CC1CCCC1C)C1CCCC1.
What is the InChIKey of cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane?
The InChIKey is XPPYPOARSMIGBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35P/c1-15-7-5-9-17(15)13-20(19-11-3-4-12-19)14-18-10-6-8-16(18)2/h15-19H,3-14H2,1-2H3.
What are the key properties of cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane?
cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane has a molecular weight of 294.46 g/mol, XLogP of 6.28, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-bis[(2-methylcyclopentyl)methyl]phosphane is sourced from PubChem (CID 59045194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).