[4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane

C10H18F2NOP — CID 129298886

IUPAC[4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane
SMILESCC1(COC2CCN(P)CC2)CC1(F)F
InChIInChI=1S/C10H18F2NOP/c1-9(6-10(9,11)12)7-14-8-2-4-13(15)5-3-8/h8H,2-7,15H2,1H3
InChIKeyOGKKBFAOYFLXGO-UHFFFAOYSA-N
MW237.23 g/mol
LogP2.30
Rot. Bonds3

About [4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane

[4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane (PubChem CID 129298886) has the molecular formula C10H18F2NOP and a molecular weight of 237.23 g/mol. Its IUPAC name is [4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane.

Molecular Properties

Compound Name[4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane
PubChem CID129298886
Molecular FormulaC10H18F2NOP
Molecular Weight237.23 g/mol
Exact Mass237.11
IUPAC Name[4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane
SMILESCC1(COC2CCN(P)CC2)CC1(F)F
InChIInChI=1S/C10H18F2NOP/c1-9(6-10(9,11)12)7-14-8-2-4-13(15)5-3-8/h8H,2-7,15H2,1H3
InChIKeyOGKKBFAOYFLXGO-UHFFFAOYSA-N
XLogP2.30
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.23
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane?
The IUPAC name of [4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane (CID 129298886) is [4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane.
What is the SMILES notation for [4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane?
The canonical SMILES for [4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane is CC1(COC2CCN(P)CC2)CC1(F)F.
What is the InChIKey of [4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane?
The InChIKey is OGKKBFAOYFLXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2NOP/c1-9(6-10(9,11)12)7-14-8-2-4-13(15)5-3-8/h8H,2-7,15H2,1H3.
What are the key properties of [4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane?
[4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane has a molecular weight of 237.23 g/mol, XLogP of 2.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2,2-difluoro-1-methylcyclopropyl)methoxy]piperidin-1-yl]phosphane is sourced from PubChem (CID 129298886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).