6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide

C17H14FN3O — CID 4732291

IUPAC6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide
SMILESCc1cc(C(=O)NNc2ccccc2)c2cc(F)ccc2n1
InChIInChI=1S/C17H14FN3O/c1-11-9-15(14-10-12(18)7-8-16(14)19-11)17(22)21-20-13-5-3-2-4-6-13/h2-10,20H,1H3,(H,21,22)
InChIKeyGXMQFMAAHIKAIM-UHFFFAOYSA-N
MW295.32 g/mol
LogP3.44
Rot. Bonds3

About 6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide

6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide (PubChem CID 4732291) has the molecular formula C17H14FN3O and a molecular weight of 295.32 g/mol. Its IUPAC name is 6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide.

Molecular Properties

Compound Name6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide
PubChem CID4732291
Molecular FormulaC17H14FN3O
Molecular Weight295.32 g/mol
Exact Mass295.11
IUPAC Name6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide
SMILESCc1cc(C(=O)NNc2ccccc2)c2cc(F)ccc2n1
InChIInChI=1S/C17H14FN3O/c1-11-9-15(14-10-12(18)7-8-16(14)19-11)17(22)21-20-13-5-3-2-4-6-13/h2-10,20H,1H3,(H,21,22)
InChIKeyGXMQFMAAHIKAIM-UHFFFAOYSA-N
XLogP3.44
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.32
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-fluoro-N'-(4-fluorobenzoyl)-2-methylquinoline-4-carbohydrazide
CID 4732337
6-fluoro-N-(3-hydroxyphenyl)-2-methylquinoline-4-carboxamide
CID 108789542
6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide
CID 4732359
6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide
CID 4732352
6-fluoro-2-methyl-N-(6-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 4732250
6-fluoro-N-(2-hydroxypropyl)-2-methylquinoline-4-carboxamide
CID 110489253
2-[(6-fluoro-2-methylquinoline-4-carbonyl)amino]-5-iodobenzoic acid
CID 108789589
dimethyl 5-[(6-fluoro-2-methylquinoline-4-carbonyl)amino]benzene-1,3-dicarboxylate
CID 4732272
N-[(1S)-1,2-diphenylethyl]-6-fluoro-2-methylquinoline-4-carboxamide
CID 7237810
5-bromo-2-[(6-fluoro-2-methylquinoline-4-carbonyl)amino]benzoic acid
CID 108789645
6-fluoro-2-methyl-N-(4-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 4732260
methyl 3-(6-fluoro-2-methylquinolin-4-yl)-3-oxopropanoate
CID 82666021

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide?
The IUPAC name of 6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide (CID 4732291) is 6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide.
What is the SMILES notation for 6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide?
The canonical SMILES for 6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide is Cc1cc(C(=O)NNc2ccccc2)c2cc(F)ccc2n1.
What is the InChIKey of 6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide?
The InChIKey is GXMQFMAAHIKAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O/c1-11-9-15(14-10-12(18)7-8-16(14)19-11)17(22)21-20-13-5-3-2-4-6-13/h2-10,20H,1H3,(H,21,22).
What are the key properties of 6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide?
6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide has a molecular weight of 295.32 g/mol, XLogP of 3.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide is sourced from PubChem (CID 4732291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).