(2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide

C11H12F3N3O2 — CID 95976114

IUPAC(2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide
SMILESO=C(Nc1cc(C(F)(F)F)c[nH]c1=O)[C@H]1CCCN1
InChIInChI=1S/C11H12F3N3O2/c12-11(13,14)6-4-8(9(18)16-5-6)17-10(19)7-2-1-3-15-7/h4-5,7,15H,1-3H2,(H,16,18)(H,17,19)/t7-/m1/s1
InChIKeyDKXQHBXIVRJKMI-SSDOTTSWSA-N
MW275.23 g/mol
LogP1.08
Rot. Bonds2

About (2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide

(2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide (PubChem CID 95976114) has the molecular formula C11H12F3N3O2 and a molecular weight of 275.23 g/mol. Its IUPAC name is (2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide
PubChem CID95976114
Molecular FormulaC11H12F3N3O2
Molecular Weight275.23 g/mol
Exact Mass275.09
IUPAC Name(2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide
SMILESO=C(Nc1cc(C(F)(F)F)c[nH]c1=O)[C@H]1CCCN1
InChIInChI=1S/C11H12F3N3O2/c12-11(13,14)6-4-8(9(18)16-5-6)17-10(19)7-2-1-3-15-7/h4-5,7,15H,1-3H2,(H,16,18)(H,17,19)/t7-/m1/s1
InChIKeyDKXQHBXIVRJKMI-SSDOTTSWSA-N
XLogP1.08
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.23
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide (CID 95976114) is (2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide is O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)[C@H]1CCCN1.
What is the InChIKey of (2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide?
The InChIKey is DKXQHBXIVRJKMI-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H12F3N3O2/c12-11(13,14)6-4-8(9(18)16-5-6)17-10(19)7-2-1-3-15-7/h4-5,7,15H,1-3H2,(H,16,18)(H,17,19)/t7-/m1/s1.
What are the key properties of (2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide?
(2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide has a molecular weight of 275.23 g/mol, XLogP of 1.08, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 95976114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).