N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide

C19H22FN3O2 — CID 84597050

IUPACN-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)N(C)C2CCN(c3ccc(F)cc3)CC2)cc(=O)[nH]1
InChIInChI=1S/C19H22FN3O2/c1-13-11-14(12-18(24)21-13)19(25)22(2)16-7-9-23(10-8-16)17-5-3-15(20)4-6-17/h3-6,11-12,16H,7-10H2,1-2H3,(H,21,24)
InChIKeyKPYFIXDXVFKLCM-UHFFFAOYSA-N
MW343.40 g/mol
LogP2.56
Rot. Bonds3

About N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide

N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide (PubChem CID 84597050) has the molecular formula C19H22FN3O2 and a molecular weight of 343.40 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide
PubChem CID84597050
Molecular FormulaC19H22FN3O2
Molecular Weight343.40 g/mol
Exact Mass343.17
IUPAC NameN-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)N(C)C2CCN(c3ccc(F)cc3)CC2)cc(=O)[nH]1
InChIInChI=1S/C19H22FN3O2/c1-13-11-14(12-18(24)21-13)19(25)22(2)16-7-9-23(10-8-16)17-5-3-15(20)4-6-17/h3-6,11-12,16H,7-10H2,1-2H3,(H,21,24)
InChIKeyKPYFIXDXVFKLCM-UHFFFAOYSA-N
XLogP2.56
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.40
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-[1-(4-fluorophenyl)piperidin-4-yl]-N-methylbenzamide
CID 86887457
2-(5-bromo-2,4-dioxopyrimidin-1-yl)-N-[1-(4-fluorophenyl)piperidin-4-yl]-N-methylacetamide
CID 86887522
N-cyclopentyl-N-methyl-4-morpholin-4-ylbenzamide
CID 43910092
N-[1-(4-fluorophenyl)piperidin-4-yl]-3-hydroxy-4-methoxy-N-methylpyridine-2-carboxamide
CID 166309265
(3R)-3-[(2-chlorobenzoyl)amino]-N-[1-(4-fluorophenyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide
CID 66798635
N-cyclopropyl-N-methyl-2-oxo-1H-pyridine-4-carboxamide
CID 103763001
N-[1-(4-fluorophenyl)piperidin-4-yl]-N-methyl-2-[5-(4-methylphenyl)tetrazol-2-yl]acetamide
CID 86887445
2-(2-chloro-4-fluorophenoxy)-N-[1-(4-fluorophenyl)piperidin-4-yl]-N-methylpropanamide
CID 86944611
3-fluoro-N,5-dimethyl-N-(4-oxocyclohexyl)benzamide
CID 113395910
(E)-3-(5-bromothiophen-3-yl)-N-[1-(4-fluorophenyl)piperidin-4-yl]-N-methylprop-2-enamide
CID 86960802
1-benzoyl-N-[1-(4-fluorophenyl)piperidin-4-yl]-N-methylpiperidine-3-carboxamide
CID 86901383
N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide
CID 115745650

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide (CID 84597050) is N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide is Cc1cc(C(=O)N(C)C2CCN(c3ccc(F)cc3)CC2)cc(=O)[nH]1.
What is the InChIKey of N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide?
The InChIKey is KPYFIXDXVFKLCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O2/c1-13-11-14(12-18(24)21-13)19(25)22(2)16-7-9-23(10-8-16)17-5-3-15(20)4-6-17/h3-6,11-12,16H,7-10H2,1-2H3,(H,21,24).
What are the key properties of N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide?
N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide has a molecular weight of 343.40 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 84597050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).