4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine

C11H21F2NO — CID 137419273

IUPAC4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine
SMILESCC(C)CN1CCC(COC(F)F)CC1
InChIInChI=1S/C11H21F2NO/c1-9(2)7-14-5-3-10(4-6-14)8-15-11(12)13/h9-11H,3-8H2,1-2H3
InChIKeySFNMKUYAQPRMBH-UHFFFAOYSA-N
MW221.29 g/mol
LogP2.59
Rot. Bonds5

About 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine

4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine (PubChem CID 137419273) has the molecular formula C11H21F2NO and a molecular weight of 221.29 g/mol. Its IUPAC name is 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine.

Molecular Properties

Compound Name4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine
PubChem CID137419273
Molecular FormulaC11H21F2NO
Molecular Weight221.29 g/mol
Exact Mass221.16
IUPAC Name4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine
SMILESCC(C)CN1CCC(COC(F)F)CC1
InChIInChI=1S/C11H21F2NO/c1-9(2)7-14-5-3-10(4-6-14)8-15-11(12)13/h9-11H,3-8H2,1-2H3
InChIKeySFNMKUYAQPRMBH-UHFFFAOYSA-N
XLogP2.59
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.29
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine?
The IUPAC name of 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine (CID 137419273) is 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine.
What is the SMILES notation for 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine?
The canonical SMILES for 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine is CC(C)CN1CCC(COC(F)F)CC1.
What is the InChIKey of 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine?
The InChIKey is SFNMKUYAQPRMBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F2NO/c1-9(2)7-14-5-3-10(4-6-14)8-15-11(12)13/h9-11H,3-8H2,1-2H3.
What are the key properties of 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine?
4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine has a molecular weight of 221.29 g/mol, XLogP of 2.59, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethoxymethyl)-1-(2-methylpropyl)piperidine is sourced from PubChem (CID 137419273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).