N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide

C17H16F3N3O2S — CID 166596005

IUPACN-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(C2CC(=O)NC(c3cscc3C(F)(F)F)C2)ccn1
InChIInChI=1S/C17H16F3N3O2S/c1-9(24)22-15-5-10(2-3-21-15)11-4-14(23-16(25)6-11)12-7-26-8-13(12)17(18,19)20/h2-3,5,7-8,11,14H,4,6H2,1H3,(H,23,25)(H,21,22,24)
InChIKeyUOYCUUHUFUTCQT-UHFFFAOYSA-N
MW383.40 g/mol
LogP3.86
Rot. Bonds3

About N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide

N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide (PubChem CID 166596005) has the molecular formula C17H16F3N3O2S and a molecular weight of 383.40 g/mol. Its IUPAC name is N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide
PubChem CID166596005
Molecular FormulaC17H16F3N3O2S
Molecular Weight383.40 g/mol
Exact Mass383.09
IUPAC NameN-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(C2CC(=O)NC(c3cscc3C(F)(F)F)C2)ccn1
InChIInChI=1S/C17H16F3N3O2S/c1-9(24)22-15-5-10(2-3-21-15)11-4-14(23-16(25)6-11)12-7-26-8-13(12)17(18,19)20/h2-3,5,7-8,11,14H,4,6H2,1H3,(H,23,25)(H,21,22,24)
InChIKeyUOYCUUHUFUTCQT-UHFFFAOYSA-N
XLogP3.86
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.40
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide with MolForge

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Related Compounds

6-methyl-N-2-pyridinyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 2970481
N-[4-[[2-amino-5-(4-methylthiophen-2-yl)-3-pyridinyl]iminomethyl]-2-pyridinyl]cyclopropanecarboxamide
CID 151422375
2-(2-methylpropyl)-1-oxo-N-pyridin-2-yl-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide
CID 22549205
N-[4-(4-oxospiro[5,6-dihydrothieno[3,2-c]pyridine-7,1'-cyclohexane]-2-yl)-2-pyridinyl]acetamide
CID 70695872
(3S,4S)-2-(2-methylpropyl)-1-oxo-N-pyridin-2-yl-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide
CID 92310735
3-Ethyl-2-(propan-2-ylamino)-7-(1-pyridin-2-ylpiperidin-4-yl)thieno[3,2-d]pyrimidin-4-one
CID 118729751
2-(cyclopentylamino)-5-(2-thienyl)pyrido[2,3-d]pyrimidin-4(3H)-one
CID 135630026
(1,1-Dioxothian-4-yl)-[2-(5-methylthiophen-2-yl)-4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone
CID 118013392
6-chloro-3-[(1S)-1-{[3-fluoro-4-(4-
CID 145866145
US11208423, Example 42
CID 163200985
US11208423, Example 52
CID 163200988
US11219618, Example 36
CID 166596002

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide?
The IUPAC name of N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide (CID 166596005) is N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide is CC(=O)Nc1cc(C2CC(=O)NC(c3cscc3C(F)(F)F)C2)ccn1.
What is the InChIKey of N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide?
The InChIKey is UOYCUUHUFUTCQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F3N3O2S/c1-9(24)22-15-5-10(2-3-21-15)11-4-14(23-16(25)6-11)12-7-26-8-13(12)17(18,19)20/h2-3,5,7-8,11,14H,4,6H2,1H3,(H,23,25)(H,21,22,24).
What are the key properties of N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide?
N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide has a molecular weight of 383.40 g/mol, XLogP of 3.86, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-oxo-6-[4-(trifluoromethyl)thiophen-3-yl]piperidin-4-yl]-2-pyridinyl]acetamide is sourced from PubChem (CID 166596005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).