N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide

C19H15F3N4O2 — CID 139782579

IUPACN-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide
SMILESCC(=O)Nc1c(C)cnc2c(NC(=O)c3cnccc3C(F)(F)F)cccc12
InChIInChI=1S/C19H15F3N4O2/c1-10-8-24-17-12(16(10)25-11(2)27)4-3-5-15(17)26-18(28)13-9-23-7-6-14(13)19(20,21)22/h3-9H,1-2H3,(H,26,28)(H,24,25,27)
InChIKeyQIXSSZHPBJWQDO-UHFFFAOYSA-N
MW388.35 g/mol
LogP4.17
Rot. Bonds3

About N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide

N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 139782579) has the molecular formula C19H15F3N4O2 and a molecular weight of 388.35 g/mol. Its IUPAC name is N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID139782579
Molecular FormulaC19H15F3N4O2
Molecular Weight388.35 g/mol
Exact Mass388.11
IUPAC NameN-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide
SMILESCC(=O)Nc1c(C)cnc2c(NC(=O)c3cnccc3C(F)(F)F)cccc12
InChIInChI=1S/C19H15F3N4O2/c1-10-8-24-17-12(16(10)25-11(2)27)4-3-5-15(17)26-18(28)13-9-23-7-6-14(13)19(20,21)22/h3-9H,1-2H3,(H,26,28)(H,24,25,27)
InChIKeyQIXSSZHPBJWQDO-UHFFFAOYSA-N
XLogP4.17
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.35
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-methyl-4-(phenylcarbamoylamino)quinolin-8-yl]-4-(trifluoromethyl)pyridine-3-carboxamide
CID 67600268
N-[3-methyl-4-[methyl(methylcarbamoyl)amino]quinolin-8-yl]-4-(trifluoromethyl)pyridine-3-carboxamide
CID 67613982
N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide
CID 19592320
N-[4-(2-benzoylhydrazinyl)-3-methylquinolin-8-yl]-2-(trifluoromethyl)benzamide
CID 139782331
N-[3-bromo-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]-4-(trifluoromethyl)pyridine-3-carboxamide
CID 139782527
N-[3-methyl-4-(5-methylimidazol-1-yl)quinolin-8-yl]-2-(trifluoromethyl)benzamide
CID 139782543
N-[3-chloro-4-(2-oxo-3-phenylimidazolidin-1-yl)quinolin-8-yl]-4-(trifluoromethyl)pyridine-3-carboxamide
CID 139782558
N-[3-methyl-4-(1-methylimidazol-2-yl)sulfanylquinolin-8-yl]-2-(trifluoromethyl)benzamide
CID 139782614
N-[4-(2-methylphenyl)phenyl]-4-(trifluoromethyl)pyridine-3-carboxamide
CID 70338497
4-(trifluoromethyl)-N-trimethylsilylpyridine-3-carboxamide
CID 170555219
ethane;1-[4-(trifluoromethyl)-3-pyridinyl]ethanone
CID 142909767
2,4-dimethyl-N-[3-methyl-4-(phenylcarbamoylamino)quinolin-8-yl]pyridine-3-carboxamide
CID 67600616

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide (CID 139782579) is N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide is CC(=O)Nc1c(C)cnc2c(NC(=O)c3cnccc3C(F)(F)F)cccc12.
What is the InChIKey of N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is QIXSSZHPBJWQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F3N4O2/c1-10-8-24-17-12(16(10)25-11(2)27)4-3-5-15(17)26-18(28)13-9-23-7-6-14(13)19(20,21)22/h3-9H,1-2H3,(H,26,28)(H,24,25,27).
What are the key properties of N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide?
N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 388.35 g/mol, XLogP of 4.17, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 139782579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).