N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide

C17H11F3N2O2S — CID 71423053

IUPACN-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1sc2cnccc2c1C(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C17H11F3N2O2S/c1-9(23)22-16-14(12-5-6-21-8-13(12)25-16)15(24)10-3-2-4-11(7-10)17(18,19)20/h2-8H,1H3,(H,22,23)
InChIKeySMVMUJJELMXRRF-UHFFFAOYSA-N
MW364.35 g/mol
LogP4.50
Rot. Bonds3

About N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide

N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide (PubChem CID 71423053) has the molecular formula C17H11F3N2O2S and a molecular weight of 364.35 g/mol. Its IUPAC name is N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide.

Molecular Properties

Compound NameN-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide
PubChem CID71423053
Molecular FormulaC17H11F3N2O2S
Molecular Weight364.35 g/mol
Exact Mass364.05
IUPAC NameN-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1sc2cnccc2c1C(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C17H11F3N2O2S/c1-9(23)22-16-14(12-5-6-21-8-13(12)25-16)15(24)10-3-2-4-11(7-10)17(18,19)20/h2-8H,1H3,(H,22,23)
InChIKeySMVMUJJELMXRRF-UHFFFAOYSA-N
XLogP4.50
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.35
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-benzoylthieno[2,3-c]pyridin-2-yl)acetamide
CID 71423060
N-[3-(naphthalene-1-carbonyl)thieno[2,3-c]pyridin-2-yl]acetamide
CID 71423052
methyl 2-[[3-(trifluoromethyl)benzoyl]amino]-1-benzothiophene-3-carboxylate
CID 7673157
N-(6-acetamido-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide
CID 2374848
[4-[3-(trifluoromethyl)benzoyl]phenyl]-[3-(trifluoromethyl)phenyl]methanone
CID 162354741
[2-(pyridin-3-ylmethylamino)-1,3-thiazol-5-yl]-[3-(trifluoromethyl)phenyl]methanone
CID 151619613
N-[1-[3-(trifluoromethyl)phenyl]ethylideneamino]pyridine-3-carboxamide
CID 4836895
3-acetamido-N-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]benzamide
CID 46513424
(3-methylphenyl)-[3-(trifluoromethyl)phenyl]methanone
CID 55026756
N,4,5-trimethyl-2-[[3-(trifluoromethyl)benzoyl]amino]thiophene-3-carboxamide
CID 7520896
N-(7-fluoro-6-methyl-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide
CID 89461424
(3,4-difluorophenyl)-[3-(trifluoromethyl)phenyl]methanone
CID 43338250

Frequently Asked Questions

What is the IUPAC name of N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide?
The IUPAC name of N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide (CID 71423053) is N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide.
What is the SMILES notation for N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide?
The canonical SMILES for N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide is CC(=O)Nc1sc2cnccc2c1C(=O)c1cccc(C(F)(F)F)c1.
What is the InChIKey of N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide?
The InChIKey is SMVMUJJELMXRRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F3N2O2S/c1-9(23)22-16-14(12-5-6-21-8-13(12)25-16)15(24)10-3-2-4-11(7-10)17(18,19)20/h2-8H,1H3,(H,22,23).
What are the key properties of N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide?
N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide has a molecular weight of 364.35 g/mol, XLogP of 4.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3-(trifluoromethyl)benzoyl]thieno[2,3-c]pyridin-2-yl]acetamide is sourced from PubChem (CID 71423053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).