N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide

C13H11F2N3O2 — CID 2447949

IUPACN-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2ccc(OC(F)F)cc2)cn1
InChIInChI=1S/C13H11F2N3O2/c1-8-6-17-11(7-16-8)12(19)18-9-2-4-10(5-3-9)20-13(14)15/h2-7,13H,1H3,(H,18,19)
InChIKeyUFRZVRPUAWGJFP-UHFFFAOYSA-N
MW279.25 g/mol
LogP2.64
Rot. Bonds4

About N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide

N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide (PubChem CID 2447949) has the molecular formula C13H11F2N3O2 and a molecular weight of 279.25 g/mol. Its IUPAC name is N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide
PubChem CID2447949
Molecular FormulaC13H11F2N3O2
Molecular Weight279.25 g/mol
Exact Mass279.08
IUPAC NameN-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2ccc(OC(F)F)cc2)cn1
InChIInChI=1S/C13H11F2N3O2/c1-8-6-17-11(7-16-8)12(19)18-9-2-4-10(5-3-9)20-13(14)15/h2-7,13H,1H3,(H,18,19)
InChIKeyUFRZVRPUAWGJFP-UHFFFAOYSA-N
XLogP2.64
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.25
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide
CID 47222176
5-bromo-N-[4-(difluoromethoxy)phenyl]pyridine-2-carboxamide
CID 62953190
N-(4-iodophenyl)-5-methylpyrazine-2-carboxamide
CID 2388228
5-methyl-N-(4-phenylphenyl)pyrazine-2-carboxamide
CID 7926006
6-chloro-N-[4-(difluoromethoxy)phenyl]pyrazine-2-carboxamide
CID 103186812
N-[4-(difluoromethoxy)phenyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 7941086
N-(4-acetamidophenyl)-4-(difluoromethoxy)benzamide
CID 2168312
1,3-bis[4-(difluoromethoxy)phenyl]urea
CID 11537485
N-[4-(azepan-1-yl)phenyl]-5-methylpyrazine-2-carboxamide
CID 51197527
6-amino-N-[4-(difluoromethoxy)phenyl]pyridine-3-carboxamide
CID 62154747
N-[4-(diethylcarbamoyl)phenyl]-5-methylpyrazine-2-carboxamide
CID 8503925
N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide
CID 46421778

Frequently Asked Questions

What is the IUPAC name of N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide?
The IUPAC name of N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide (CID 2447949) is N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide?
The canonical SMILES for N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide is Cc1cnc(C(=O)Nc2ccc(OC(F)F)cc2)cn1.
What is the InChIKey of N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide?
The InChIKey is UFRZVRPUAWGJFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2N3O2/c1-8-6-17-11(7-16-8)12(19)18-9-2-4-10(5-3-9)20-13(14)15/h2-7,13H,1H3,(H,18,19).
What are the key properties of N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide?
N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide has a molecular weight of 279.25 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(difluoromethoxy)phenyl]-5-methylpyrazine-2-carboxamide is sourced from PubChem (CID 2447949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).