(2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane

C14H28P2 — CID 141074063

IUPAC(2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane
SMILESCC(P1[C@@H](C)CC[C@@H]1C)P1[C@@H](C)CC[C@@H]1C
InChIInChI=1S/C14H28P2/c1-10-6-7-11(2)15(10)14(5)16-12(3)8-9-13(16)4/h10-14H,6-9H2,1-5H3/t10-,11-,12-,13-/m0/s1
InChIKeyXYHXIEJPQNFZED-CYDGBPFRSA-N
MW258.33 g/mol
LogP5.44
Rot. Bonds2

About (2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane

(2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane (PubChem CID 141074063) has the molecular formula C14H28P2 and a molecular weight of 258.33 g/mol. Its IUPAC name is (2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane.

Molecular Properties

Compound Name(2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane
PubChem CID141074063
Molecular FormulaC14H28P2
Molecular Weight258.33 g/mol
Exact Mass258.17
IUPAC Name(2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane
SMILESCC(P1[C@@H](C)CC[C@@H]1C)P1[C@@H](C)CC[C@@H]1C
InChIInChI=1S/C14H28P2/c1-10-6-7-11(2)15(10)14(5)16-12(3)8-9-13(16)4/h10-14H,6-9H2,1-5H3/t10-,11-,12-,13-/m0/s1
InChIKeyXYHXIEJPQNFZED-CYDGBPFRSA-N
XLogP5.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.33
LogP ≤ 55.44
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

2-methyl-1,5-di(propan-2-yl)phospholane
CID 146200751
1-[2-(2,5-dimethylphospholan-1-yl)ethyl]-2,5-dimethylphospholane
CID 20643197
1,2-dimethylcyclobutane;2-methylpropane
CID 143728444
(2R)-1-[(Z)-1-[(2R,5R)-2,5-dimethylphospholan-1-yl]-3,3-dimethylbut-1-en-2-yl]-2,5-dimethylphospholane
CID 140850102
(2R,5R)-N-diethylphosphanyl-2,5-dimethyl-N-propan-2-ylphospholan-1-amine
CID 140850167
(2R,5R)-1-[2-[(2R,5R)-2,5-dimethylphospholan-1-yl]cyclopentyl]-2,5-dimethylphospholane
CID 139306014
bis(1-[2-(2,5-dimethylphospholan-1-yl)phenyl]-2,5-dimethylphospholane);gold(1+);chloride
CID 23641823
2-deuteriopropan-2-ylcyclopropane
CID 164822454
(2S)-1,2-dimethylphosphetane
CID 59207148
1,2-dimethylcyclohexane;2-methylpropane
CID 143562785
bis((2S,5S)-1-cyclopentyl-2,5-dimethylphospholane);iron
CID 155884997
1,2-dimethyl-5-(6-methylheptan-3-yl)phospholane
CID 155301887

Frequently Asked Questions

What is the IUPAC name of (2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane?
The IUPAC name of (2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane (CID 141074063) is (2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane.
What is the SMILES notation for (2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane?
The canonical SMILES for (2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane is CC(P1[C@@H](C)CC[C@@H]1C)P1[C@@H](C)CC[C@@H]1C.
What is the InChIKey of (2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane?
The InChIKey is XYHXIEJPQNFZED-CYDGBPFRSA-N. The full InChI is InChI=1S/C14H28P2/c1-10-6-7-11(2)15(10)14(5)16-12(3)8-9-13(16)4/h10-14H,6-9H2,1-5H3/t10-,11-,12-,13-/m0/s1.
What are the key properties of (2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane?
(2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane has a molecular weight of 258.33 g/mol, XLogP of 5.44, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane is sourced from PubChem (CID 141074063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).