(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine

C10H20FN — CID 58030220

IUPAC(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine
SMILESCC(F)[C@@H]1CCCN(C(C)C)C1
InChIInChI=1S/C10H20FN/c1-8(2)12-6-4-5-10(7-12)9(3)11/h8-10H,4-7H2,1-3H3/t9?,10-/m1/s1
InChIKeyHLUJXUYGMBSQES-QVDQXJPCSA-N
MW173.28 g/mol
LogP2.46
Rot. Bonds2

About (3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine

(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine (PubChem CID 58030220) has the molecular formula C10H20FN and a molecular weight of 173.28 g/mol. Its IUPAC name is (3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine
PubChem CID58030220
Molecular FormulaC10H20FN
Molecular Weight173.28 g/mol
Exact Mass173.16
IUPAC Name(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine
SMILESCC(F)[C@@H]1CCCN(C(C)C)C1
InChIInChI=1S/C10H20FN/c1-8(2)12-6-4-5-10(7-12)9(3)11/h8-10H,4-7H2,1-3H3/t9?,10-/m1/s1
InChIKeyHLUJXUYGMBSQES-QVDQXJPCSA-N
XLogP2.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.28
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine?
The IUPAC name of (3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine (CID 58030220) is (3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine.
What is the SMILES notation for (3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine?
The canonical SMILES for (3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine is CC(F)[C@@H]1CCCN(C(C)C)C1.
What is the InChIKey of (3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine?
The InChIKey is HLUJXUYGMBSQES-QVDQXJPCSA-N. The full InChI is InChI=1S/C10H20FN/c1-8(2)12-6-4-5-10(7-12)9(3)11/h8-10H,4-7H2,1-3H3/t9?,10-/m1/s1.
What are the key properties of (3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine?
(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine has a molecular weight of 173.28 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine is sourced from PubChem (CID 58030220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).