N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide

C13H12FN3O2 — CID 103793620

IUPACN-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)Nc2cc(N)ccc2F)cc1=O
InChIInChI=1S/C13H12FN3O2/c1-17-5-4-8(6-12(17)18)13(19)16-11-7-9(15)2-3-10(11)14/h2-7H,15H2,1H3,(H,16,19)
InChIKeyFAHCJWBKCQKFMQ-UHFFFAOYSA-N
MW261.26 g/mol
LogP1.36
Rot. Bonds2

About N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide

N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 103793620) has the molecular formula C13H12FN3O2 and a molecular weight of 261.26 g/mol. Its IUPAC name is N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID103793620
Molecular FormulaC13H12FN3O2
Molecular Weight261.26 g/mol
Exact Mass261.09
IUPAC NameN-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)Nc2cc(N)ccc2F)cc1=O
InChIInChI=1S/C13H12FN3O2/c1-17-5-4-8(6-12(17)18)13(19)16-11-7-9(15)2-3-10(11)14/h2-7H,15H2,1H3,(H,16,19)
InChIKeyFAHCJWBKCQKFMQ-UHFFFAOYSA-N
XLogP1.36
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.26
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(5-amino-2-methylphenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 106813423
N-(5-bromo-2,4-difluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 99824990
N-(5-amino-2-fluorophenyl)-3,5-dimethylbenzamide
CID 16771732
N-(2-bromo-4-chlorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103774923
N-(5-amino-2-fluorophenyl)-4-propan-2-ylbenzamide
CID 18072371
N-(5-amino-2-fluorophenyl)-5-methylfuran-3-carboxamide
CID 114818556
N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103891192
N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103610749
N-(5-amino-2-fluorophenyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 18071479
N-(5-amino-2-fluorophenyl)-3-propan-2-yloxybenzamide
CID 62919110
N-(5-amino-2-fluorophenyl)-1,3-benzodioxole-5-carboxamide
CID 16771364
N-(2-chloro-4-cyanophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103799723

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide (CID 103793620) is N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide is Cn1ccc(C(=O)Nc2cc(N)ccc2F)cc1=O.
What is the InChIKey of N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is FAHCJWBKCQKFMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O2/c1-17-5-4-8(6-12(17)18)13(19)16-11-7-9(15)2-3-10(11)14/h2-7H,15H2,1H3,(H,16,19).
What are the key properties of N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide?
N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 261.26 g/mol, XLogP of 1.36, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 103793620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).