[2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane

C27H38P2 — CID 58900670

IUPAC[2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane
SMILESCC(C)[C@H]1CC[C@H](C(C)C)P1C1CCCC1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H38P2/c1-20(2)24-18-19-25(21(3)4)29(24)27-17-11-16-26(27)28(22-12-7-5-8-13-22)23-14-9-6-10-15-23/h5-10,12-15,20-21,24-27H,11,16-19H2,1-4H3/t24-,25-,26?,27?/m1/s1
InChIKeyUXNLKRWOTACVBI-BINWOUKTSA-N
MW424.55 g/mol
LogP7.37
Rot. Bonds6

About [2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane

[2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane (PubChem CID 58900670) has the molecular formula C27H38P2 and a molecular weight of 424.55 g/mol. Its IUPAC name is [2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane.

Molecular Properties

Compound Name[2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane
PubChem CID58900670
Molecular FormulaC27H38P2
Molecular Weight424.55 g/mol
Exact Mass424.24
IUPAC Name[2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane
SMILESCC(C)[C@H]1CC[C@H](C(C)C)P1C1CCCC1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H38P2/c1-20(2)24-18-19-25(21(3)4)29(24)27-17-11-16-26(27)28(22-12-7-5-8-13-22)23-14-9-6-10-15-23/h5-10,12-15,20-21,24-27H,11,16-19H2,1-4H3/t24-,25-,26?,27?/m1/s1
InChIKeyUXNLKRWOTACVBI-BINWOUKTSA-N
XLogP7.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.55
LogP ≤ 57.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

cyclopentane;diphenyl-(2-propan-2-ylcyclopentyl)phosphane
CID 90737985
[(1S)-1-[(1R,2R)-2-diphenylphosphanylcyclopentyl]ethyl]-diphenylphosphane
CID 141093024
(1R)-1-[(1S,2S)-2-diphenylphosphanylcyclopentyl]ethanamine
CID 90131117
[(1S)-1-[(1S,2S)-2-diphenylphosphanylcyclopentyl]-2-methylpropyl]-diphenylphosphane
CID 11698892
carbanide;bis(diphenyl-[2-[(1S)-1-phenylethyl]cyclopentyl]phosphane);iron(2+);methane
CID 162272143
1-(2-diphenylphosphanylcyclopentyl)ethanol;iron;methylcyclopentane
CID 159987676
[(1R,2R)-2-diphenylphosphanylcyclohexyl]-diphenylphosphane
CID 59800266
[(2R)-2-[(1R)-2-diphenylphosphanylcyclopentyl]cyclopentyl]-diphenylphosphane
CID 15361438
carbanide;diphenyl-[2-[(1R)-1-phenylethyl]cyclopentyl]phosphane;iron(2+);[(1R)-1-(2-methylcyclopentyl)ethyl]benzene
CID 162295074
dicyclohexyl-[(1S)-1-[(1S,2R)-2-diphenylphosphanylcyclopentyl]ethyl]phosphane
CID 129406680
cyclopentane;1-(2-diphenylphosphanylcyclopentyl)-N,N-dimethylethanamine;iron;hydrate
CID 171371546
dicyclohexyl-[1-[(2R)-2-diphenylphosphanylcyclopentyl]ethyl]phosphane
CID 121477932

Frequently Asked Questions

What is the IUPAC name of [2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane?
The IUPAC name of [2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane (CID 58900670) is [2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane.
What is the SMILES notation for [2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane?
The canonical SMILES for [2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane is CC(C)[C@H]1CC[C@H](C(C)C)P1C1CCCC1P(c1ccccc1)c1ccccc1.
What is the InChIKey of [2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane?
The InChIKey is UXNLKRWOTACVBI-BINWOUKTSA-N. The full InChI is InChI=1S/C27H38P2/c1-20(2)24-18-19-25(21(3)4)29(24)27-17-11-16-26(27)28(22-12-7-5-8-13-22)23-14-9-6-10-15-23/h5-10,12-15,20-21,24-27H,11,16-19H2,1-4H3/t24-,25-,26?,27?/m1/s1.
What are the key properties of [2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane?
[2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane has a molecular weight of 424.55 g/mol, XLogP of 7.37, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]cyclopentyl]-diphenylphosphane is sourced from PubChem (CID 58900670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).