1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide

C14H19FN2O2 — CID 134375286

IUPAC1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide
SMILESCNC(=O)c1cccn(C2(C)CCC(F)CC2)c1=O
InChIInChI=1S/C14H19FN2O2/c1-14(7-5-10(15)6-8-14)17-9-3-4-11(13(17)19)12(18)16-2/h3-4,9-10H,5-8H2,1-2H3,(H,16,18)
InChIKeyVLNMKVYBKLONNL-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.84
Rot. Bonds2

About 1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide

1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide (PubChem CID 134375286) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is 1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide
PubChem CID134375286
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC Name1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide
SMILESCNC(=O)c1cccn(C2(C)CCC(F)CC2)c1=O
InChIInChI=1S/C14H19FN2O2/c1-14(7-5-10(15)6-8-14)17-9-3-4-11(13(17)19)12(18)16-2/h3-4,9-10H,5-8H2,1-2H3,(H,16,18)
InChIKeyVLNMKVYBKLONNL-UHFFFAOYSA-N
XLogP1.84
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide (CID 134375286) is 1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide is CNC(=O)c1cccn(C2(C)CCC(F)CC2)c1=O.
What is the InChIKey of 1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide?
The InChIKey is VLNMKVYBKLONNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-14(7-5-10(15)6-8-14)17-9-3-4-11(13(17)19)12(18)16-2/h3-4,9-10H,5-8H2,1-2H3,(H,16,18).
What are the key properties of 1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide?
1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide has a molecular weight of 266.32 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-1-methylcyclohexyl)-N-methyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 134375286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).