6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide

C17H13FN4O2 — CID 4732352

IUPAC6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide
SMILESCc1cc(C(=O)NNC(=O)c2ccccn2)c2cc(F)ccc2n1
InChIInChI=1S/C17H13FN4O2/c1-10-8-13(12-9-11(18)5-6-14(12)20-10)16(23)21-22-17(24)15-4-2-3-7-19-15/h2-9H,1H3,(H,21,23)(H,22,24)
InChIKeyMNBWOVWMOCEWRD-UHFFFAOYSA-N
MW324.32 g/mol
LogP2.15
Rot. Bonds2

About 6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide

6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide (PubChem CID 4732352) has the molecular formula C17H13FN4O2 and a molecular weight of 324.32 g/mol. Its IUPAC name is 6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide.

Molecular Properties

Compound Name6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide
PubChem CID4732352
Molecular FormulaC17H13FN4O2
Molecular Weight324.32 g/mol
Exact Mass324.10
IUPAC Name6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide
SMILESCc1cc(C(=O)NNC(=O)c2ccccn2)c2cc(F)ccc2n1
InChIInChI=1S/C17H13FN4O2/c1-10-8-13(12-9-11(18)5-6-14(12)20-10)16(23)21-22-17(24)15-4-2-3-7-19-15/h2-9H,1H3,(H,21,23)(H,22,24)
InChIKeyMNBWOVWMOCEWRD-UHFFFAOYSA-N
XLogP2.15
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.32
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide
CID 4732291
6-fluoro-N'-(4-fluorobenzoyl)-2-methylquinoline-4-carbohydrazide
CID 4732337
6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide
CID 4732359
6-fluoro-N-(3-hydroxyphenyl)-2-methylquinoline-4-carboxamide
CID 108789542
6-fluoro-2-methyl-N-(4-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 4732260
6-fluoro-2-methyl-N-(6-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 4732250
[6-fluoro-2-(trifluoromethyl)quinolin-4-yl]-pyridin-2-ylmethanone
CID 125474347
6-fluoro-N-(2-hydroxypropyl)-2-methylquinoline-4-carboxamide
CID 110489253
dimethyl 5-[(6-fluoro-2-methylquinoline-4-carbonyl)amino]benzene-1,3-dicarboxylate
CID 4732272
2-[(6-fluoro-2-methylquinoline-4-carbonyl)amino]-5-iodobenzoic acid
CID 108789589
N'-(2-fluorobenzoyl)pyridine-2-carbohydrazide
CID 27661912
N-[(1S)-1,2-diphenylethyl]-6-fluoro-2-methylquinoline-4-carboxamide
CID 7237810

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide?
The IUPAC name of 6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide (CID 4732352) is 6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide.
What is the SMILES notation for 6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide?
The canonical SMILES for 6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide is Cc1cc(C(=O)NNC(=O)c2ccccn2)c2cc(F)ccc2n1.
What is the InChIKey of 6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide?
The InChIKey is MNBWOVWMOCEWRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN4O2/c1-10-8-13(12-9-11(18)5-6-14(12)20-10)16(23)21-22-17(24)15-4-2-3-7-19-15/h2-9H,1H3,(H,21,23)(H,22,24).
What are the key properties of 6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide?
6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide has a molecular weight of 324.32 g/mol, XLogP of 2.15, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide is sourced from PubChem (CID 4732352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).