5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide

C14H14ClN3O2 — CID 107246554

IUPAC5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide
SMILESCOc1c(C)ccc(NC(=O)c2cnc(Cl)cn2)c1C
InChIInChI=1S/C14H14ClN3O2/c1-8-4-5-10(9(2)13(8)20-3)18-14(19)11-6-17-12(15)7-16-11/h4-7H,1-3H3,(H,18,19)
InChIKeyZYUWHOAGXFMGGY-UHFFFAOYSA-N
MW291.74 g/mol
LogP3.01
Rot. Bonds3

About 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide

5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide (PubChem CID 107246554) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide
PubChem CID107246554
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC Name5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide
SMILESCOc1c(C)ccc(NC(=O)c2cnc(Cl)cn2)c1C
InChIInChI=1S/C14H14ClN3O2/c1-8-4-5-10(9(2)13(8)20-3)18-14(19)11-6-17-12(15)7-16-11/h4-7H,1-3H3,(H,18,19)
InChIKeyZYUWHOAGXFMGGY-UHFFFAOYSA-N
XLogP3.01
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)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

4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide
CID 81227385
N-(5-acetamido-2-methylphenyl)-5-chloropyrazine-2-carboxamide
CID 103803621
5-chloro-N-(6-chloro-2-methyl-3-pyridinyl)pyrazine-2-carboxamide
CID 107329768
5-chloro-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 103817028
6-bromo-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide
CID 66462513
4-[(5-chloropyrazine-2-carbonyl)amino]-3-methylbenzoic acid
CID 107371405
3-[(5-chloropyrazine-2-carbonyl)amino]-4-methylbenzoic acid
CID 107371391
2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide
CID 105380636
5-chloro-N-[2-methyl-5-(methylcarbamoyl)phenyl]pyrazine-2-carboxamide
CID 107246307
5-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide
CID 63860127
1-(2-aminoethyl)-N-(3-methoxy-2,4-dimethylphenyl)imidazole-4-carboxamide
CID 107496194
4-amino-N-(3-methoxy-2,4-dimethylphenyl)benzamide
CID 43697374

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide (CID 107246554) is 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide is COc1c(C)ccc(NC(=O)c2cnc(Cl)cn2)c1C.
What is the InChIKey of 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide?
The InChIKey is ZYUWHOAGXFMGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c1-8-4-5-10(9(2)13(8)20-3)18-14(19)11-6-17-12(15)7-16-11/h4-7H,1-3H3,(H,18,19).
What are the key properties of 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide?
5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide has a molecular weight of 291.74 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107246554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).