N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide

C18H15F3N4O — CID 19592320

IUPACN-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide
SMILESCc1cnc2c(NC(=O)c3ccccc3C(F)(F)F)cccc2c1NN
InChIInChI=1S/C18H15F3N4O/c1-10-9-23-16-12(15(10)25-22)6-4-8-14(16)24-17(26)11-5-2-3-7-13(11)18(19,20)21/h2-9H,22H2,1H3,(H,23,25)(H,24,26)
InChIKeyUWCSVKCPPYZITK-UHFFFAOYSA-N
MW360.34 g/mol
LogP4.10
Rot. Bonds3

About N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide

N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide (PubChem CID 19592320) has the molecular formula C18H15F3N4O and a molecular weight of 360.34 g/mol. Its IUPAC name is N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide
PubChem CID19592320
Molecular FormulaC18H15F3N4O
Molecular Weight360.34 g/mol
Exact Mass360.12
IUPAC NameN-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide
SMILESCc1cnc2c(NC(=O)c3ccccc3C(F)(F)F)cccc2c1NN
InChIInChI=1S/C18H15F3N4O/c1-10-9-23-16-12(15(10)25-22)6-4-8-14(16)24-17(26)11-5-2-3-7-13(11)18(19,20)21/h2-9H,22H2,1H3,(H,23,25)(H,24,26)
InChIKeyUWCSVKCPPYZITK-UHFFFAOYSA-N
XLogP4.10
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.34
LogP ≤ 54.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[4-(2-benzoylhydrazinyl)-3-methylquinolin-8-yl]-2-(trifluoromethyl)benzamide
CID 139782331
N-(4-acetamido-3-methylquinolin-8-yl)-4-(trifluoromethyl)pyridine-3-carboxamide
CID 139782579
N-[3-methyl-4-(5-methylimidazol-1-yl)quinolin-8-yl]-2-(trifluoromethyl)benzamide
CID 139782543
N-[3-methyl-4-(phenylcarbamoylamino)quinolin-8-yl]-4-(trifluoromethyl)pyridine-3-carboxamide
CID 67600268
N-[3-methyl-4-(1-methylimidazol-2-yl)sulfanylquinolin-8-yl]-2-(trifluoromethyl)benzamide
CID 139782614
N-quinolin-5-yl-2-(trifluoromethyl)benzamide
CID 26242319
N-[3-methyl-4-[methyl(methylcarbamoyl)amino]quinolin-8-yl]-4-(trifluoromethyl)pyridine-3-carboxamide
CID 67613982
N-[3-methyl-2-[[4-(trifluoromethyl)benzoyl]amino]phenyl]-2-(trifluoromethyl)benzamide
CID 87595402
3-methyl-2-[[2-(trifluoromethyl)benzoyl]amino]benzoic acid
CID 16774965
N-[2-(trifluoromethyl)phenyl]naphthalene-1-carboxamide
CID 1278699
2-(trifluoromethyl)-N-(2,4,6-trimethylphenyl)benzamide
CID 7899789
2-bromo-3-methyl-N-[2-(trifluoromethyl)phenyl]benzamide
CID 103857081

Frequently Asked Questions

What is the IUPAC name of N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide?
The IUPAC name of N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide (CID 19592320) is N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide?
The canonical SMILES for N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide is Cc1cnc2c(NC(=O)c3ccccc3C(F)(F)F)cccc2c1NN.
What is the InChIKey of N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide?
The InChIKey is UWCSVKCPPYZITK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F3N4O/c1-10-9-23-16-12(15(10)25-22)6-4-8-14(16)24-17(26)11-5-2-3-7-13(11)18(19,20)21/h2-9H,22H2,1H3,(H,23,25)(H,24,26).
What are the key properties of N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide?
N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide has a molecular weight of 360.34 g/mol, XLogP of 4.10, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydrazinyl-3-methylquinolin-8-yl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 19592320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).