(2S)-1,2-dimethylphosphetane

C5H11P — CID 59207148

IUPAC(2S)-1,2-dimethylphosphetane
SMILESC[C@H]1CCP1C
InChIInChI=1S/C5H11P/c1-5-3-4-6(5)2/h5H,3-4H2,1-2H3/t5-,6?/m0/s1
InChIKeyNFOHFJJDUGNTBR-ZBHICJROSA-N
MW102.12 g/mol
LogP1.89
Rot. Bonds

About (2S)-1,2-dimethylphosphetane

(2S)-1,2-dimethylphosphetane (PubChem CID 59207148) has the molecular formula C5H11P and a molecular weight of 102.12 g/mol. Its IUPAC name is (2S)-1,2-dimethylphosphetane.

Molecular Properties

Compound Name(2S)-1,2-dimethylphosphetane
PubChem CID59207148
Molecular FormulaC5H11P
Molecular Weight102.12 g/mol
Exact Mass102.06
IUPAC Name(2S)-1,2-dimethylphosphetane
SMILESC[C@H]1CCP1C
InChIInChI=1S/C5H11P/c1-5-3-4-6(5)2/h5H,3-4H2,1-2H3/t5-,6?/m0/s1
InChIKeyNFOHFJJDUGNTBR-ZBHICJROSA-N
XLogP1.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.12
LogP ≤ 51.89
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

1-[2-(2,5-dimethylphospholan-1-yl)ethyl]-2,5-dimethylphospholane
CID 20643197
2-methyl-1-methylsulfanylphospholane
CID 143295123
(2S)-2,5-dimethyloxolane
CID 118613003
(2S,5S)-1-[1-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane
CID 141074063
ethane;methylcyclopropane
CID 158329065
(2R,5R)-1-[2-[(2R,5R)-2,5-dimethylphospholan-1-yl]cyclopentyl]-2,5-dimethylphospholane
CID 139306014
(2S)-2,5-dimethylpyrrolidine;ethane
CID 177006469
(3R,4S)-1,3,4-trimethylphospholane
CID 23279881
bis((2S,5S)-1-cyclopentyl-2,5-dimethylphospholane);iron
CID 155884997
(2S,4S)-1-cyclopentyl-2,4-dimethylphosphetane
CID 123179204
dicyclohexyl-[(1S,2S)-1-methylphospholan-2-yl]phosphane
CID 58698014
bis(1,4-dimethylcyclohexane);methane
CID 161326462

Frequently Asked Questions

What is the IUPAC name of (2S)-1,2-dimethylphosphetane?
The IUPAC name of (2S)-1,2-dimethylphosphetane (CID 59207148) is (2S)-1,2-dimethylphosphetane.
What is the SMILES notation for (2S)-1,2-dimethylphosphetane?
The canonical SMILES for (2S)-1,2-dimethylphosphetane is C[C@H]1CCP1C.
What is the InChIKey of (2S)-1,2-dimethylphosphetane?
The InChIKey is NFOHFJJDUGNTBR-ZBHICJROSA-N. The full InChI is InChI=1S/C5H11P/c1-5-3-4-6(5)2/h5H,3-4H2,1-2H3/t5-,6?/m0/s1.
What are the key properties of (2S)-1,2-dimethylphosphetane?
(2S)-1,2-dimethylphosphetane has a molecular weight of 102.12 g/mol, XLogP of 1.89, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1,2-dimethylphosphetane is sourced from PubChem (CID 59207148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).