N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide

C21H26FN3O3 — CID 91639043

IUPACN-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
SMILESCOc1cn(CC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)c(C)cc1=O
InChIInChI=1S/C21H26FN3O3/c1-15-11-19(26)20(28-2)13-25(15)14-21(27)23-18-7-9-24(10-8-18)12-16-3-5-17(22)6-4-16/h3-6,11,13,18H,7-10,12,14H2,1-2H3,(H,23,27)
InChIKeyLPNVADKIPYXZSH-UHFFFAOYSA-N
MW387.46 g/mol
LogP2.09
Rot. Bonds6

About N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide

N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide (PubChem CID 91639043) has the molecular formula C21H26FN3O3 and a molecular weight of 387.46 g/mol. Its IUPAC name is N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
PubChem CID91639043
Molecular FormulaC21H26FN3O3
Molecular Weight387.46 g/mol
Exact Mass387.20
IUPAC NameN-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
SMILESCOc1cn(CC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)c(C)cc1=O
InChIInChI=1S/C21H26FN3O3/c1-15-11-19(26)20(28-2)13-25(15)14-21(27)23-18-7-9-24(10-8-18)12-16-3-5-17(22)6-4-16/h3-6,11,13,18H,7-10,12,14H2,1-2H3,(H,23,27)
InChIKeyLPNVADKIPYXZSH-UHFFFAOYSA-N
XLogP2.09
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.46
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide with MolForge

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Related Compounds

N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
CID 91639863
2-(3,4-dimethoxyphenyl)-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]acetamide
CID 55959801
N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide
CID 71702291
2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-[(3-fluoro-4-methoxyphenyl)methyl]piperidin-4-yl]acetamide
CID 55957752
N-cyclopentyl-2-[5-methoxy-4-oxo-2-(piperidin-1-ylmethyl)-1-pyridinyl]acetamide
CID 44826930
N-cyclopropyl-2-[5-methoxy-4-oxo-2-[(4-phenylpiperidin-1-yl)methyl]-1-pyridinyl]acetamide
CID 75489675
N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(2,4,5-trichlorophenoxy)acetamide
CID 55847982
2,2-difluoro-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]propanamide
CID 158389196
N-[(4-fluorophenyl)methyl]-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide
CID 30544573
2,2,2-trifluoro-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]acetamide
CID 126711751
N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-(2-methoxyphenyl)acetamide
CID 18121021
2-(4-fluorophenyl)-N-[1-(2-methoxy-4,5-dimethylphenyl)sulfonylpiperidin-4-yl]acetamide
CID 108559494

Frequently Asked Questions

What is the IUPAC name of N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide (CID 91639043) is N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide is COc1cn(CC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)c(C)cc1=O.
What is the InChIKey of N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
The InChIKey is LPNVADKIPYXZSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26FN3O3/c1-15-11-19(26)20(28-2)13-25(15)14-21(27)23-18-7-9-24(10-8-18)12-16-3-5-17(22)6-4-16/h3-6,11,13,18H,7-10,12,14H2,1-2H3,(H,23,27).
What are the key properties of N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide has a molecular weight of 387.46 g/mol, XLogP of 2.09, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 91639043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).