4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide

C18H19F3N4O2 — CID 172663685

IUPAC4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide
SMILESCc1ccn(C2CCNCC2)c(=O)c1C(=O)Nc1cncc(C(F)(F)F)c1
InChIInChI=1S/C18H19F3N4O2/c1-11-4-7-25(14-2-5-22-6-3-14)17(27)15(11)16(26)24-13-8-12(9-23-10-13)18(19,20)21/h4,7-10,14,22H,2-3,5-6H2,1H3,(H,24,26)
InChIKeyKUXZOVLVTGHTKF-UHFFFAOYSA-N
MW380.37 g/mol
LogP2.75
Rot. Bonds3

About 4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide

4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide (PubChem CID 172663685) has the molecular formula C18H19F3N4O2 and a molecular weight of 380.37 g/mol. Its IUPAC name is 4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide
PubChem CID172663685
Molecular FormulaC18H19F3N4O2
Molecular Weight380.37 g/mol
Exact Mass380.15
IUPAC Name4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide
SMILESCc1ccn(C2CCNCC2)c(=O)c1C(=O)Nc1cncc(C(F)(F)F)c1
InChIInChI=1S/C18H19F3N4O2/c1-11-4-7-25(14-2-5-22-6-3-14)17(27)15(11)16(26)24-13-8-12(9-23-10-13)18(19,20)21/h4,7-10,14,22H,2-3,5-6H2,1H3,(H,24,26)
InChIKeyKUXZOVLVTGHTKF-UHFFFAOYSA-N
XLogP2.75
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.37
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3H-benzimidazol-5-yl)-4-methyl-2-oxo-1-piperidin-4-ylpyridine-3-carboxamide
CID 172664179
N-[3-(dimethylamino)phenyl]-4-methyl-2-oxo-1-piperidin-4-ylpyridine-3-carboxamide;dihydrochloride
CID 172912666
4-methyl-N-[3-[2-(methylamino)-2-oxoethyl]phenyl]-2-oxo-1-piperidin-4-ylpyridine-3-carboxamide
CID 172666990
4-methyl-2-oxo-N-(1-oxo-3H-2-benzofuran-5-yl)-1-piperidin-4-ylpyridine-3-carboxamide;hydrochloride
CID 172911814
N-(2-acetamido-5-methylphenyl)-4-methyl-2-oxo-1-piperidin-4-ylpyridine-3-carboxamide
CID 172664109
4-methyl-N-[4-(4-methyl-1,2,4-triazol-3-yl)phenyl]-2-oxo-1-piperidin-4-ylpyridine-3-carboxamide;dihydrochloride
CID 172912636
N-(1,3-diethyl-6-methyl-2-oxobenzimidazol-5-yl)-4-methyl-2-oxo-1-piperidin-4-ylpyridine-3-carboxamide
CID 172673603
4-methyl-2-oxo-1-piperidin-4-yl-N-[4-(2-pyridin-2-ylethoxy)phenyl]pyridine-3-carboxamide;dihydrochloride
CID 172911120
N-(1-ethylbenzimidazol-2-yl)-4-methyl-2-oxo-1-piperidin-4-ylpyridine-3-carboxamide
CID 175643277
4-methyl-N-[5-(trifluoromethyl)-3-pyridinyl]benzamide
CID 174184894
N-[cyclopropyl-(1-methylimidazol-2-yl)methyl]-4-methyl-2-oxo-1-piperidin-4-ylpyridine-3-carboxamide
CID 172674256
N-[2-(3-fluorophenyl)ethyl]-4-methyl-2-oxo-1-piperidin-4-ylpyridine-3-carboxamide
CID 172669654

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of 4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide (CID 172663685) is 4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide is Cc1ccn(C2CCNCC2)c(=O)c1C(=O)Nc1cncc(C(F)(F)F)c1.
What is the InChIKey of 4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide?
The InChIKey is KUXZOVLVTGHTKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F3N4O2/c1-11-4-7-25(14-2-5-22-6-3-14)17(27)15(11)16(26)24-13-8-12(9-23-10-13)18(19,20)21/h4,7-10,14,22H,2-3,5-6H2,1H3,(H,24,26).
What are the key properties of 4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide?
4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide has a molecular weight of 380.37 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-oxo-1-piperidin-4-yl-N-[5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 172663685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).