2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide

C20H17FN2O — CID 92500204

IUPAC2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide
SMILESCc1ccc([C@@H](NC(=O)c2ccccc2F)c2cccnc2)cc1
InChIInChI=1S/C20H17FN2O/c1-14-8-10-15(11-9-14)19(16-5-4-12-22-13-16)23-20(24)17-6-2-3-7-18(17)21/h2-13,19H,1H3,(H,23,24)/t19-/m1/s1
InChIKeyYBPICZVALUZFLU-LJQANCHMSA-N
MW320.37 g/mol
LogP4.05
Rot. Bonds4

About 2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide

2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide (PubChem CID 92500204) has the molecular formula C20H17FN2O and a molecular weight of 320.37 g/mol. Its IUPAC name is 2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide
PubChem CID92500204
Molecular FormulaC20H17FN2O
Molecular Weight320.37 g/mol
Exact Mass320.13
IUPAC Name2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide
SMILESCc1ccc([C@@H](NC(=O)c2ccccc2F)c2cccnc2)cc1
InChIInChI=1S/C20H17FN2O/c1-14-8-10-15(11-9-14)19(16-5-4-12-22-13-16)23-20(24)17-6-2-3-7-18(17)21/h2-13,19H,1H3,(H,23,24)/t19-/m1/s1
InChIKeyYBPICZVALUZFLU-LJQANCHMSA-N
XLogP4.05
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(R)-(3,4-dimethylphenyl)-pyridin-3-ylmethyl]-2-fluorobenzamide
CID 92500240
N-[(S)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide
CID 92500168
N-[(4-methylphenyl)-phenylmethyl]pyridine-3-carboxamide
CID 51151137
N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]thiophene-2-carboxamide
CID 92500192
2,2-dimethyl-N-[(S)-(4-methylphenyl)-pyridin-3-ylmethyl]propanamide
CID 92500199
2-fluoro-N-[1-(4-methylphenyl)ethyl]benzamide
CID 46590164
2-fluoro-4-methyl-N-(1-pyridin-3-ylethyl)benzamide
CID 79778156
3-methoxy-N-[(S)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide
CID 92500173
4-ethoxy-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide
CID 92500203
N-[(4-chlorophenyl)-pyridin-3-ylmethyl]-2-(4-methylphenoxy)acetamide
CID 20897097
N-[(4-chlorophenyl)-pyridin-3-ylmethyl]furan-2-carboxamide
CID 20897090
2,5-dimethyl-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 100743905

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide?
The IUPAC name of 2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide (CID 92500204) is 2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide?
The canonical SMILES for 2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide is Cc1ccc([C@@H](NC(=O)c2ccccc2F)c2cccnc2)cc1.
What is the InChIKey of 2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide?
The InChIKey is YBPICZVALUZFLU-LJQANCHMSA-N. The full InChI is InChI=1S/C20H17FN2O/c1-14-8-10-15(11-9-14)19(16-5-4-12-22-13-16)23-20(24)17-6-2-3-7-18(17)21/h2-13,19H,1H3,(H,23,24)/t19-/m1/s1.
What are the key properties of 2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide?
2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide has a molecular weight of 320.37 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[(R)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide is sourced from PubChem (CID 92500204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).