N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide

C19H21FN2O2 — CID 166305087

IUPACN-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)NC2(c3ccccc3F)CC(C)C2)cn1C
InChIInChI=1S/C19H21FN2O2/c1-12-9-19(10-12,15-6-4-5-7-16(15)20)21-18(24)14-11-22(3)13(2)8-17(14)23/h4-8,11-12H,9-10H2,1-3H3,(H,21,24)
InChIKeyUEERJFLSLQMBEA-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.89
Rot. Bonds3

About N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide

N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide (PubChem CID 166305087) has the molecular formula C19H21FN2O2 and a molecular weight of 328.39 g/mol. Its IUPAC name is N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide
PubChem CID166305087
Molecular FormulaC19H21FN2O2
Molecular Weight328.39 g/mol
Exact Mass328.16
IUPAC NameN-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)NC2(c3ccccc3F)CC(C)C2)cn1C
InChIInChI=1S/C19H21FN2O2/c1-12-9-19(10-12,15-6-4-5-7-16(15)20)21-18(24)14-11-22(3)13(2)8-17(14)23/h4-8,11-12H,9-10H2,1-3H3,(H,21,24)
InChIKeyUEERJFLSLQMBEA-UHFFFAOYSA-N
XLogP2.89
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide?
The IUPAC name of N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide (CID 166305087) is N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide?
The canonical SMILES for N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide is Cc1cc(=O)c(C(=O)NC2(c3ccccc3F)CC(C)C2)cn1C.
What is the InChIKey of N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide?
The InChIKey is UEERJFLSLQMBEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O2/c1-12-9-19(10-12,15-6-4-5-7-16(15)20)21-18(24)14-11-22(3)13(2)8-17(14)23/h4-8,11-12H,9-10H2,1-3H3,(H,21,24).
What are the key properties of N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide?
N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide has a molecular weight of 328.39 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-fluorophenyl)-3-methylcyclobutyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide is sourced from PubChem (CID 166305087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).