N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide

C14H18F3N3O — CID 114909185

IUPACN-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(C(F)(F)F)cn1)C1CCCNC1
InChIInChI=1S/C14H18F3N3O/c1-2-20(11-4-3-7-18-9-11)13(21)12-6-5-10(8-19-12)14(15,16)17/h5-6,8,11,18H,2-4,7,9H2,1H3
InChIKeyBDYJHJDVKMGTIC-UHFFFAOYSA-N
MW301.31 g/mol
LogP2.31
Rot. Bonds3

About N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide

N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 114909185) has the molecular formula C14H18F3N3O and a molecular weight of 301.31 g/mol. Its IUPAC name is N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID114909185
Molecular FormulaC14H18F3N3O
Molecular Weight301.31 g/mol
Exact Mass301.14
IUPAC NameN-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(C(F)(F)F)cn1)C1CCCNC1
InChIInChI=1S/C14H18F3N3O/c1-2-20(11-4-3-7-18-9-11)13(21)12-6-5-10(8-19-12)14(15,16)17/h5-6,8,11,18H,2-4,7,9H2,1H3
InChIKeyBDYJHJDVKMGTIC-UHFFFAOYSA-N
XLogP2.31
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.31
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-propyl-N-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115737122
5-fluoro-N-piperidin-3-yl-N-propylpyridine-2-carboxamide
CID 104639262
N-ethyl-N-pyrrolidin-3-yl-4-(trifluoromethyl)benzamide
CID 60806173
N-methyl-N-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide;dihydrochloride
CID 119552569
N-ethyl-6-methyl-N-piperidin-3-ylpyridine-3-carboxamide
CID 63636559
N-ethyl-N-piperidin-3-ylpyridazine-4-carboxamide
CID 104671440
4-ethoxy-N-ethyl-N-piperidin-3-ylbenzamide
CID 60807243
N-ethyl-N-piperidin-3-yl-1-(2,2,2-trifluoroethyl)pyrrole-2-carboxamide
CID 114610281
N-ethyl-2-methyl-N-piperidin-3-yl-1,3-thiazole-4-carboxamide
CID 65198740
2-chloro-N-ethyl-N-piperidin-3-ylbenzamide
CID 63638302
3-bromo-N-ethyl-5-fluoro-N-piperidin-3-ylbenzamide
CID 63637955
5-chloro-N-ethyl-2-fluoro-N-piperidin-3-ylbenzamide
CID 63637963

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide (CID 114909185) is N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide is CCN(C(=O)c1ccc(C(F)(F)F)cn1)C1CCCNC1.
What is the InChIKey of N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is BDYJHJDVKMGTIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F3N3O/c1-2-20(11-4-3-7-18-9-11)13(21)12-6-5-10(8-19-12)14(15,16)17/h5-6,8,11,18H,2-4,7,9H2,1H3.
What are the key properties of N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide?
N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 301.31 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-piperidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 114909185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).