6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide

C13H16F3N3O2 — CID 140671080

IUPAC6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide
SMILESNC(=O)c1ccc(OC(N2CCCCC2)C(F)(F)F)nc1
InChIInChI=1S/C13H16F3N3O2/c14-13(15,16)12(19-6-2-1-3-7-19)21-10-5-4-9(8-18-10)11(17)20/h4-5,8,12H,1-3,6-7H2,(H2,17,20)
InChIKeyCYNGBXCXHMZTTC-UHFFFAOYSA-N
MW303.28 g/mol
LogP1.93
Rot. Bonds4

About 6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide

6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide (PubChem CID 140671080) has the molecular formula C13H16F3N3O2 and a molecular weight of 303.28 g/mol. Its IUPAC name is 6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide
PubChem CID140671080
Molecular FormulaC13H16F3N3O2
Molecular Weight303.28 g/mol
Exact Mass303.12
IUPAC Name6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide
SMILESNC(=O)c1ccc(OC(N2CCCCC2)C(F)(F)F)nc1
InChIInChI=1S/C13H16F3N3O2/c14-13(15,16)12(19-6-2-1-3-7-19)21-10-5-4-9(8-18-10)11(17)20/h4-5,8,12H,1-3,6-7H2,(H2,17,20)
InChIKeyCYNGBXCXHMZTTC-UHFFFAOYSA-N
XLogP1.93
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[4-[cyclohexyl(piperidin-1-yl)methyl]phenoxy]pyridine-3-carboxamide
CID 90911796
6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride
CID 165153609
6-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride
CID 69276901
6-(2-hydroxyethoxy)pyridine-3-carboxamide
CID 166748970
6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide
CID 64574041
6-methoxy-N-[(2S)-2-piperidin-1-ylpropyl]pyridine-3-carboxamide
CID 94633091
6-butoxypyridine-3-carboxamide
CID 506622
2-[(5-carbamoyl-2-pyridinyl)oxy]acetic acid
CID 114335315
4-(6-propan-2-yloxy-3-pyridinyl)benzoic acid
CID 67256782
6-[(4-methyl-1-oxo-2,3-dihydroinden-5-yl)oxy]pyridine-3-carboxamide
CID 59750675
6-(4-carbamoyl-2,6-dimethylphenoxy)pyridine-3-carboxylic acid
CID 65454117
6-(difluoromethoxy)-N-propan-2-ylpyridine-3-carboxamide
CID 155585909

Frequently Asked Questions

What is the IUPAC name of 6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide?
The IUPAC name of 6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide (CID 140671080) is 6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide.
What is the SMILES notation for 6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide?
The canonical SMILES for 6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide is NC(=O)c1ccc(OC(N2CCCCC2)C(F)(F)F)nc1.
What is the InChIKey of 6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide?
The InChIKey is CYNGBXCXHMZTTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F3N3O2/c14-13(15,16)12(19-6-2-1-3-7-19)21-10-5-4-9(8-18-10)11(17)20/h4-5,8,12H,1-3,6-7H2,(H2,17,20).
What are the key properties of 6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide?
6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide has a molecular weight of 303.28 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2,2-trifluoro-1-piperidin-1-ylethoxy)pyridine-3-carboxamide is sourced from PubChem (CID 140671080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).