2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide

C18H15FN2O — CID 110733867

IUPAC2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide
SMILESCN(Cc1cnc2ccccc2c1)C(=O)c1ccccc1F
InChIInChI=1S/C18H15FN2O/c1-21(18(22)15-7-3-4-8-16(15)19)12-13-10-14-6-2-5-9-17(14)20-11-13/h2-11H,12H2,1H3
InChIKeyZPSSUTKSZCWNEE-UHFFFAOYSA-N
MW294.33 g/mol
LogP3.65
Rot. Bonds3

About 2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide

2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide (PubChem CID 110733867) has the molecular formula C18H15FN2O and a molecular weight of 294.33 g/mol. Its IUPAC name is 2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide
PubChem CID110733867
Molecular FormulaC18H15FN2O
Molecular Weight294.33 g/mol
Exact Mass294.12
IUPAC Name2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide
SMILESCN(Cc1cnc2ccccc2c1)C(=O)c1ccccc1F
InChIInChI=1S/C18H15FN2O/c1-21(18(22)15-7-3-4-8-16(15)19)12-13-10-14-6-2-5-9-17(14)20-11-13/h2-11H,12H2,1H3
InChIKeyZPSSUTKSZCWNEE-UHFFFAOYSA-N
XLogP3.65
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dimethoxy-N-methyl-N-(quinolin-3-ylmethyl)benzamide
CID 110733874
2-fluoro-N-[(4-methoxyphenyl)methyl]-N-methylbenzamide
CID 60631214
4-acetamido-N-methyl-N-(quinolin-3-ylmethyl)benzamide
CID 110745532
2-fluoro-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 60715430
2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide
CID 110733880
N-[[3-(aminomethyl)phenyl]methyl]-2-fluoro-N-methylbenzamide
CID 43248666
N-methyl-2-(4-methylphenyl)-N-(quinolin-3-ylmethyl)propanamide
CID 91781862
N-methyl-4-phenoxy-N-(quinolin-3-ylmethyl)butanamide
CID 110745516
N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide
CID 110732902
N-[[4-(difluoromethoxy)phenyl]methyl]-2-fluoro-N-methylbenzamide
CID 134059081
2-(2-fluorophenyl)-N-(quinolin-3-ylmethyl)acetamide
CID 110733805
(2R)-2-hydroxy-2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide
CID 95230216

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide?
The IUPAC name of 2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide (CID 110733867) is 2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide.
What is the SMILES notation for 2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide?
The canonical SMILES for 2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide is CN(Cc1cnc2ccccc2c1)C(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide?
The InChIKey is ZPSSUTKSZCWNEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O/c1-21(18(22)15-7-3-4-8-16(15)19)12-13-10-14-6-2-5-9-17(14)20-11-13/h2-11H,12H2,1H3.
What are the key properties of 2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide?
2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide has a molecular weight of 294.33 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide is sourced from PubChem (CID 110733867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).