(2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine

C7H8F3N — CID 166894121

IUPAC(2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine
SMILESC[C@H]1N=CC=CC1C(F)(F)F
InChIInChI=1S/C7H8F3N/c1-5-6(7(8,9)10)3-2-4-11-5/h2-6H,1H3/t5-,6?/m1/s1
InChIKeyUILDNAWBLGCDLE-LWOQYNTDSA-N
MW163.14 g/mol
LogP2.19
Rot. Bonds

About (2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine

(2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine (PubChem CID 166894121) has the molecular formula C7H8F3N and a molecular weight of 163.14 g/mol. Its IUPAC name is (2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine.

Molecular Properties

Compound Name(2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine
PubChem CID166894121
Molecular FormulaC7H8F3N
Molecular Weight163.14 g/mol
Exact Mass163.06
IUPAC Name(2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine
SMILESC[C@H]1N=CC=CC1C(F)(F)F
InChIInChI=1S/C7H8F3N/c1-5-6(7(8,9)10)3-2-4-11-5/h2-6H,1H3/t5-,6?/m1/s1
InChIKeyUILDNAWBLGCDLE-LWOQYNTDSA-N
XLogP2.19
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.14
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine?
The IUPAC name of (2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine (CID 166894121) is (2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine.
What is the SMILES notation for (2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine?
The canonical SMILES for (2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine is C[C@H]1N=CC=CC1C(F)(F)F.
What is the InChIKey of (2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine?
The InChIKey is UILDNAWBLGCDLE-LWOQYNTDSA-N. The full InChI is InChI=1S/C7H8F3N/c1-5-6(7(8,9)10)3-2-4-11-5/h2-6H,1H3/t5-,6?/m1/s1.
What are the key properties of (2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine?
(2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine has a molecular weight of 163.14 g/mol, XLogP of 2.19, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-3-(trifluoromethyl)-2,3-dihydropyridine is sourced from PubChem (CID 166894121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).