(3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine

C10H16F3N — CID 166830344

IUPAC(3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine
SMILESCC[C@@H]1CC=C(C(F)(F)F)N(CC)C1
InChIInChI=1S/C10H16F3N/c1-3-8-5-6-9(10(11,12)13)14(4-2)7-8/h6,8H,3-5,7H2,1-2H3/t8-/m1/s1
InChIKeyMOXSNDLLTNLSBP-MRVPVSSYSA-N
MW207.24 g/mol
LogP3.18
Rot. Bonds2

About (3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine

(3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine (PubChem CID 166830344) has the molecular formula C10H16F3N and a molecular weight of 207.24 g/mol. Its IUPAC name is (3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name(3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine
PubChem CID166830344
Molecular FormulaC10H16F3N
Molecular Weight207.24 g/mol
Exact Mass207.12
IUPAC Name(3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine
SMILESCC[C@@H]1CC=C(C(F)(F)F)N(CC)C1
InChIInChI=1S/C10H16F3N/c1-3-8-5-6-9(10(11,12)13)14(4-2)7-8/h6,8H,3-5,7H2,1-2H3/t8-/m1/s1
InChIKeyMOXSNDLLTNLSBP-MRVPVSSYSA-N
XLogP3.18
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.24
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine?
The IUPAC name of (3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine (CID 166830344) is (3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine.
What is the SMILES notation for (3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine?
The canonical SMILES for (3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine is CC[C@@H]1CC=C(C(F)(F)F)N(CC)C1.
What is the InChIKey of (3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine?
The InChIKey is MOXSNDLLTNLSBP-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H16F3N/c1-3-8-5-6-9(10(11,12)13)14(4-2)7-8/h6,8H,3-5,7H2,1-2H3/t8-/m1/s1.
What are the key properties of (3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine?
(3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine has a molecular weight of 207.24 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1,3-diethyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 166830344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).