(2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane

C16H32P2 — CID 16717654

IUPAC(2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane
SMILESCC(C)(C)P1CCC[C@@H]1[C@H]1CCCP1C(C)(C)C
InChIInChI=1S/C16H32P2/c1-15(2,3)17-11-7-9-13(17)14-10-8-12-18(14)16(4,5)6/h13-14H,7-12H2,1-6H3/t13-,14-,17?,18?/m1/s1
InChIKeySJNUZTRUIDRSJK-JDPPGYRCSA-N
MW286.38 g/mol
LogP5.87
Rot. Bonds1

About (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane

(2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane (PubChem CID 16717654) has the molecular formula C16H32P2 and a molecular weight of 286.38 g/mol. Its IUPAC name is (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane.

Molecular Properties

Compound Name(2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane
PubChem CID16717654
Molecular FormulaC16H32P2
Molecular Weight286.38 g/mol
Exact Mass286.20
IUPAC Name(2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane
SMILESCC(C)(C)P1CCC[C@@H]1[C@H]1CCCP1C(C)(C)C
InChIInChI=1S/C16H32P2/c1-15(2,3)17-11-7-9-13(17)14-10-8-12-18(14)16(4,5)6/h13-14H,7-12H2,1-6H3/t13-,14-,17?,18?/m1/s1
InChIKeySJNUZTRUIDRSJK-JDPPGYRCSA-N
XLogP5.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.38
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane 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 (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane?
The IUPAC name of (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane (CID 16717654) is (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane.
What is the SMILES notation for (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane?
The canonical SMILES for (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane is CC(C)(C)P1CCC[C@@H]1[C@H]1CCCP1C(C)(C)C.
What is the InChIKey of (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane?
The InChIKey is SJNUZTRUIDRSJK-JDPPGYRCSA-N. The full InChI is InChI=1S/C16H32P2/c1-15(2,3)17-11-7-9-13(17)14-10-8-12-18(14)16(4,5)6/h13-14H,7-12H2,1-6H3/t13-,14-,17?,18?/m1/s1.
What are the key properties of (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane?
(2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane has a molecular weight of 286.38 g/mol, XLogP of 5.87, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-tert-butyl-2-[(2R)-1-tert-butylphospholan-2-yl]phospholane is sourced from PubChem (CID 16717654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).