4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine

C10H19F2NO — CID 176694209

IUPAC4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine
SMILESCOCC1CN(C(C)C)CCC1(F)F
InChIInChI=1S/C10H19F2NO/c1-8(2)13-5-4-10(11,12)9(6-13)7-14-3/h8-9H,4-7H2,1-3H3
InChIKeyPNHXYALCRLHNJP-UHFFFAOYSA-N
MW207.26 g/mol
LogP2.00
Rot. Bonds3

About 4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine

4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine (PubChem CID 176694209) has the molecular formula C10H19F2NO and a molecular weight of 207.26 g/mol. Its IUPAC name is 4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine
PubChem CID176694209
Molecular FormulaC10H19F2NO
Molecular Weight207.26 g/mol
Exact Mass207.14
IUPAC Name4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine
SMILESCOCC1CN(C(C)C)CCC1(F)F
InChIInChI=1S/C10H19F2NO/c1-8(2)13-5-4-10(11,12)9(6-13)7-14-3/h8-9H,4-7H2,1-3H3
InChIKeyPNHXYALCRLHNJP-UHFFFAOYSA-N
XLogP2.00
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine?
The IUPAC name of 4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine (CID 176694209) is 4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine.
What is the SMILES notation for 4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine?
The canonical SMILES for 4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine is COCC1CN(C(C)C)CCC1(F)F.
What is the InChIKey of 4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine?
The InChIKey is PNHXYALCRLHNJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2NO/c1-8(2)13-5-4-10(11,12)9(6-13)7-14-3/h8-9H,4-7H2,1-3H3.
What are the key properties of 4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine?
4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine has a molecular weight of 207.26 g/mol, XLogP of 2.00, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-3-(methoxymethyl)-1-propan-2-ylpiperidine is sourced from PubChem (CID 176694209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).