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

C11H22FN — CID 59001003

IUPAC1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine
SMILESCC(C)CC1CCN(CCF)CC1
InChIInChI=1S/C11H22FN/c1-10(2)9-11-3-6-13(7-4-11)8-5-12/h10-11H,3-9H2,1-2H3
InChIKeySMVAGYFJBHTRQP-UHFFFAOYSA-N
MW187.30 g/mol
LogP2.71
Rot. Bonds4

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

1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine (PubChem CID 59001003) has the molecular formula C11H22FN and a molecular weight of 187.30 g/mol. Its IUPAC name is 1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine.

Molecular Properties

Compound Name1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine
PubChem CID59001003
Molecular FormulaC11H22FN
Molecular Weight187.30 g/mol
Exact Mass187.17
IUPAC Name1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine
SMILESCC(C)CC1CCN(CCF)CC1
InChIInChI=1S/C11H22FN/c1-10(2)9-11-3-6-13(7-4-11)8-5-12/h10-11H,3-9H2,1-2H3
InChIKeySMVAGYFJBHTRQP-UHFFFAOYSA-N
XLogP2.71
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.30
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine?
The IUPAC name of 1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine (CID 59001003) is 1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine.
What is the SMILES notation for 1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine?
The canonical SMILES for 1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine is CC(C)CC1CCN(CCF)CC1.
What is the InChIKey of 1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine?
The InChIKey is SMVAGYFJBHTRQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FN/c1-10(2)9-11-3-6-13(7-4-11)8-5-12/h10-11H,3-9H2,1-2H3.
What are the key properties of 1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine?
1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine has a molecular weight of 187.30 g/mol, XLogP of 2.71, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)-4-(2-methylpropyl)piperidine is sourced from PubChem (CID 59001003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).