2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide

C15H14F2N2O2 — CID 105380636

IUPAC2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide
SMILESCOc1c(C)ccc(NC(=O)c2ccnc(F)c2F)c1C
InChIInChI=1S/C15H14F2N2O2/c1-8-4-5-11(9(2)13(8)21-3)19-15(20)10-6-7-18-14(17)12(10)16/h4-7H,1-3H3,(H,19,20)
InChIKeyQUZCLWROFNRUPU-UHFFFAOYSA-N
MW292.29 g/mol
LogP3.24
Rot. Bonds3

About 2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide

2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide (PubChem CID 105380636) has the molecular formula C15H14F2N2O2 and a molecular weight of 292.29 g/mol. Its IUPAC name is 2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide
PubChem CID105380636
Molecular FormulaC15H14F2N2O2
Molecular Weight292.29 g/mol
Exact Mass292.10
IUPAC Name2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide
SMILESCOc1c(C)ccc(NC(=O)c2ccnc(F)c2F)c1C
InChIInChI=1S/C15H14F2N2O2/c1-8-4-5-11(9(2)13(8)21-3)19-15(20)10-6-7-18-14(17)12(10)16/h4-7H,1-3H3,(H,19,20)
InChIKeyQUZCLWROFNRUPU-UHFFFAOYSA-N
XLogP3.24
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2,3-difluoro-N-(4-hydroxy-2-methylphenyl)pyridine-4-carboxamide
CID 105381289
2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide
CID 62509266
N-(2,5-difluoro-4-methylphenyl)-2,3-difluoropyridine-4-carboxamide
CID 103585463
4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide
CID 81227385
4-[(2,3-difluoropyridine-4-carbonyl)amino]-3-methylbenzoic acid
CID 105380758
N-(4-carbamoyl-2-methylphenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380697
5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide
CID 107246554
2,3-difluoro-N-(2-methyl-5-nitrophenyl)pyridine-4-carboxamide
CID 105380524
2-(aminomethyl)-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide
CID 114325733
2,3-difluoro-N-(4-methylphenyl)pyridine-4-carboxamide
CID 105380183
N-(2-bromo-5-chloro-4-methylphenyl)-2,3-difluoropyridine-4-carboxamide
CID 105381565
2,3-difluoro-N-(2-methoxyethyl)pyridine-4-carboxamide
CID 105380129

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide (CID 105380636) is 2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide is COc1c(C)ccc(NC(=O)c2ccnc(F)c2F)c1C.
What is the InChIKey of 2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide?
The InChIKey is QUZCLWROFNRUPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O2/c1-8-4-5-11(9(2)13(8)21-3)19-15(20)10-6-7-18-14(17)12(10)16/h4-7H,1-3H3,(H,19,20).
What are the key properties of 2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide?
2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide has a molecular weight of 292.29 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 105380636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).