3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide

C18H14FN3O — CID 174491616

IUPAC3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide
SMILESCc1cc(NC(=O)c2nccnc2F)ccc1-c1ccccc1
InChIInChI=1S/C18H14FN3O/c1-12-11-14(7-8-15(12)13-5-3-2-4-6-13)22-18(23)16-17(19)21-10-9-20-16/h2-11H,1H3,(H,22,23)
InChIKeyAJAGOSSZQRFOHV-UHFFFAOYSA-N
MW307.33 g/mol
LogP3.84
Rot. Bonds3

About 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide

3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide (PubChem CID 174491616) has the molecular formula C18H14FN3O and a molecular weight of 307.33 g/mol. Its IUPAC name is 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide
PubChem CID174491616
Molecular FormulaC18H14FN3O
Molecular Weight307.33 g/mol
Exact Mass307.11
IUPAC Name3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide
SMILESCc1cc(NC(=O)c2nccnc2F)ccc1-c1ccccc1
InChIInChI=1S/C18H14FN3O/c1-12-11-14(7-8-15(12)13-5-3-2-4-6-13)22-18(23)16-17(19)21-10-9-20-16/h2-11H,1H3,(H,22,23)
InChIKeyAJAGOSSZQRFOHV-UHFFFAOYSA-N
XLogP3.84
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-N-[3-methyl-4-[2-methyl-4-[(2-methylbenzoyl)amino]phenyl]phenyl]benzamide
CID 23908248
N-(4-bromo-3-methylphenyl)-3-methylpyridine-2-carboxamide
CID 62338956
3-bromo-N-(3,4-dimethylphenyl)pyridine-2-carboxamide
CID 107517768
N-(4-bromo-3-methylphenyl)-2-fluoropyridine-3-carboxamide
CID 107358538
N-(3-chloro-4-methylphenyl)-3-fluoropyridine-2-carboxamide
CID 110474858
N-(4-fluoro-3-methylphenyl)-3-(3-hydroxyprop-1-ynyl)pyridine-2-carboxamide
CID 107522279
4-[(3-bromopyridine-2-carbonyl)amino]-2-methylbenzoic acid
CID 107517066
N-[3-[(2,6-dimethylphenyl)sulfamoyl]-4-methoxyphenyl]-3-phenylpyridine-2-carboxamide
CID 168786153
N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide
CID 62340831
N-(3-amino-4-methylphenyl)-3-methyl-4-(trifluoromethyl)pyridine-2-carboxamide
CID 164905798
N-(3-chloro-4-methylphenyl)-3-(hydroxymethyl)pyrazine-2-carboxamide
CID 20866916
N-(3-chloro-4-methylphenyl)-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 43854642

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide?
The IUPAC name of 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide (CID 174491616) is 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide is Cc1cc(NC(=O)c2nccnc2F)ccc1-c1ccccc1.
What is the InChIKey of 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide?
The InChIKey is AJAGOSSZQRFOHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN3O/c1-12-11-14(7-8-15(12)13-5-3-2-4-6-13)22-18(23)16-17(19)21-10-9-20-16/h2-11H,1H3,(H,22,23).
What are the key properties of 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide?
3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide has a molecular weight of 307.33 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(3-methyl-4-phenylphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 174491616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).