N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide

C17H24F3N3O3 — CID 124848721

IUPACN-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide
SMILESC[C@@H](Oc1ncccc1C(=O)NCCN1CCOC(C)(C)C1)C(F)(F)F
InChIInChI=1S/C17H24F3N3O3/c1-12(17(18,19)20)26-15-13(5-4-6-22-15)14(24)21-7-8-23-9-10-25-16(2,3)11-23/h4-6,12H,7-11H2,1-3H3,(H,21,24)/t12-/m1/s1
InChIKeyNHNICGFVNRZQCF-GFCCVEGCSA-N
MW375.39 g/mol
LogP2.25
Rot. Bonds6

About N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide

N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide (PubChem CID 124848721) has the molecular formula C17H24F3N3O3 and a molecular weight of 375.39 g/mol. Its IUPAC name is N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide
PubChem CID124848721
Molecular FormulaC17H24F3N3O3
Molecular Weight375.39 g/mol
Exact Mass375.18
IUPAC NameN-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide
SMILESC[C@@H](Oc1ncccc1C(=O)NCCN1CCOC(C)(C)C1)C(F)(F)F
InChIInChI=1S/C17H24F3N3O3/c1-12(17(18,19)20)26-15-13(5-4-6-22-15)14(24)21-7-8-23-9-10-25-16(2,3)11-23/h4-6,12H,7-11H2,1-3H3,(H,21,24)/t12-/m1/s1
InChIKeyNHNICGFVNRZQCF-GFCCVEGCSA-N
XLogP2.25
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.39
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide?
The IUPAC name of N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide (CID 124848721) is N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide.
What is the SMILES notation for N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide?
The canonical SMILES for N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide is C[C@@H](Oc1ncccc1C(=O)NCCN1CCOC(C)(C)C1)C(F)(F)F.
What is the InChIKey of N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide?
The InChIKey is NHNICGFVNRZQCF-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H24F3N3O3/c1-12(17(18,19)20)26-15-13(5-4-6-22-15)14(24)21-7-8-23-9-10-25-16(2,3)11-23/h4-6,12H,7-11H2,1-3H3,(H,21,24)/t12-/m1/s1.
What are the key properties of N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide?
N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide has a molecular weight of 375.39 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-[(2R)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide is sourced from PubChem (CID 124848721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).