(2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide

C13H15F3N2O2 — CID 95303143

IUPAC(2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide
SMILESC[C@@H](OCC1CC1)C(=O)Nc1cccc(C(F)(F)F)n1
InChIInChI=1S/C13H15F3N2O2/c1-8(20-7-9-5-6-9)12(19)18-11-4-2-3-10(17-11)13(14,15)16/h2-4,8-9H,5-7H2,1H3,(H,17,18,19)/t8-/m1/s1
InChIKeyLIKRKZOUVJFKHO-MRVPVSSYSA-N
MW288.27 g/mol
LogP2.85
Rot. Bonds5

About (2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide

(2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide (PubChem CID 95303143) has the molecular formula C13H15F3N2O2 and a molecular weight of 288.27 g/mol. Its IUPAC name is (2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide
PubChem CID95303143
Molecular FormulaC13H15F3N2O2
Molecular Weight288.27 g/mol
Exact Mass288.11
IUPAC Name(2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide
SMILESC[C@@H](OCC1CC1)C(=O)Nc1cccc(C(F)(F)F)n1
InChIInChI=1S/C13H15F3N2O2/c1-8(20-7-9-5-6-9)12(19)18-11-4-2-3-10(17-11)13(14,15)16/h2-4,8-9H,5-7H2,1H3,(H,17,18,19)/t8-/m1/s1
InChIKeyLIKRKZOUVJFKHO-MRVPVSSYSA-N
XLogP2.85
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.27
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
The IUPAC name of (2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide (CID 95303143) is (2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide.
What is the SMILES notation for (2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
The canonical SMILES for (2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide is C[C@@H](OCC1CC1)C(=O)Nc1cccc(C(F)(F)F)n1.
What is the InChIKey of (2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
The InChIKey is LIKRKZOUVJFKHO-MRVPVSSYSA-N. The full InChI is InChI=1S/C13H15F3N2O2/c1-8(20-7-9-5-6-9)12(19)18-11-4-2-3-10(17-11)13(14,15)16/h2-4,8-9H,5-7H2,1H3,(H,17,18,19)/t8-/m1/s1.
What are the key properties of (2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
(2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide has a molecular weight of 288.27 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(cyclopropylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide is sourced from PubChem (CID 95303143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).