N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide

C18H15FN2O2 — CID 7893982

IUPACN-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide
SMILESCc1ccc(NC(=O)COc2cccc3cccnc23)cc1F
InChIInChI=1S/C18H15FN2O2/c1-12-7-8-14(10-15(12)19)21-17(22)11-23-16-6-2-4-13-5-3-9-20-18(13)16/h2-10H,11H2,1H3,(H,21,22)
InChIKeyVUKJNLGEEMRXLW-UHFFFAOYSA-N
MW310.33 g/mol
LogP3.70
Rot. Bonds4

About N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide

N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide (PubChem CID 7893982) has the molecular formula C18H15FN2O2 and a molecular weight of 310.33 g/mol. Its IUPAC name is N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide.

Molecular Properties

Compound NameN-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide
PubChem CID7893982
Molecular FormulaC18H15FN2O2
Molecular Weight310.33 g/mol
Exact Mass310.11
IUPAC NameN-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide
SMILESCc1ccc(NC(=O)COc2cccc3cccnc23)cc1F
InChIInChI=1S/C18H15FN2O2/c1-12-7-8-14(10-15(12)19)21-17(22)11-23-16-6-2-4-13-5-3-9-20-18(13)16/h2-10H,11H2,1H3,(H,21,22)
InChIKeyVUKJNLGEEMRXLW-UHFFFAOYSA-N
XLogP3.70
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.33
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide?
The IUPAC name of N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide (CID 7893982) is N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide.
What is the SMILES notation for N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide?
The canonical SMILES for N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide is Cc1ccc(NC(=O)COc2cccc3cccnc23)cc1F.
What is the InChIKey of N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide?
The InChIKey is VUKJNLGEEMRXLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O2/c1-12-7-8-14(10-15(12)19)21-17(22)11-23-16-6-2-4-13-5-3-9-20-18(13)16/h2-10H,11H2,1H3,(H,21,22).
What are the key properties of N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide?
N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide has a molecular weight of 310.33 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-methylphenyl)-2-quinolin-8-yloxyacetamide is sourced from PubChem (CID 7893982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).