N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide

C20H18FN3O — CID 75416170

IUPACN-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide
SMILESCc1ccc(CC(=O)N(Cc2cccnc2)c2ccc(F)cc2)cn1
InChIInChI=1S/C20H18FN3O/c1-15-4-5-16(13-23-15)11-20(25)24(14-17-3-2-10-22-12-17)19-8-6-18(21)7-9-19/h2-10,12-13H,11,14H2,1H3
InChIKeyIATLPASOPWGMRC-UHFFFAOYSA-N
MW335.38 g/mol
LogP3.70
Rot. Bonds5

About N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide

N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 75416170) has the molecular formula C20H18FN3O and a molecular weight of 335.38 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide
PubChem CID75416170
Molecular FormulaC20H18FN3O
Molecular Weight335.38 g/mol
Exact Mass335.14
IUPAC NameN-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide
SMILESCc1ccc(CC(=O)N(Cc2cccnc2)c2ccc(F)cc2)cn1
InChIInChI=1S/C20H18FN3O/c1-15-4-5-16(13-23-15)11-20(25)24(14-17-3-2-10-22-12-17)19-8-6-18(21)7-9-19/h2-10,12-13H,11,14H2,1H3
InChIKeyIATLPASOPWGMRC-UHFFFAOYSA-N
XLogP3.70
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 110360820
2-(4-fluorophenyl)-N-(3-methoxyphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 110360509
N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 110360828
N-(4-fluorophenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
CID 13304879
N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 69168158
N-(4-methylphenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 110360399
N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)-3-thiophen-2-ylpropanamide
CID 110360844
N-(4-fluorophenyl)-3-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 110360811
3-amino-N-(4-methylphenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 39368333
N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyrrolidine-1-carboxamide
CID 71938987
N-(4-fluorophenyl)-2,2-dimethyl-N-[[6-[methyl(2-pyridin-3-ylethyl)amino]-3-pyridinyl]methyl]propanamide
CID 24990087
N-methyl-2-pyridin-3-ylacetohydrazide
CID 116844877

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide (CID 75416170) is N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide is Cc1ccc(CC(=O)N(Cc2cccnc2)c2ccc(F)cc2)cn1.
What is the InChIKey of N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is IATLPASOPWGMRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O/c1-15-4-5-16(13-23-15)11-20(25)24(14-17-3-2-10-22-12-17)19-8-6-18(21)7-9-19/h2-10,12-13H,11,14H2,1H3.
What are the key properties of N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide?
N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 335.38 g/mol, XLogP of 3.70, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 75416170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).