5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide

C11H8ClFN4O — CID 107377043

IUPAC5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide
SMILESNc1cnc(C(=O)Nc2c(F)cccc2Cl)cn1
InChIInChI=1S/C11H8ClFN4O/c12-6-2-1-3-7(13)10(6)17-11(18)8-4-16-9(14)5-15-8/h1-5H,(H2,14,16)(H,17,18)
InChIKeyYCHMPZXKQYRPGO-UHFFFAOYSA-N
MW266.66 g/mol
LogP2.10
Rot. Bonds2

About 5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide

5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide (PubChem CID 107377043) has the molecular formula C11H8ClFN4O and a molecular weight of 266.66 g/mol. Its IUPAC name is 5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide
PubChem CID107377043
Molecular FormulaC11H8ClFN4O
Molecular Weight266.66 g/mol
Exact Mass266.04
IUPAC Name5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide
SMILESNc1cnc(C(=O)Nc2c(F)cccc2Cl)cn1
InChIInChI=1S/C11H8ClFN4O/c12-6-2-1-3-7(13)10(6)17-11(18)8-4-16-9(14)5-15-8/h1-5H,(H2,14,16)(H,17,18)
InChIKeyYCHMPZXKQYRPGO-UHFFFAOYSA-N
XLogP2.10
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.66
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide
CID 107372206
5-amino-N-(2-bromo-6-fluorophenyl)pyrazine-2-carboxamide
CID 107603346
5-amino-N-(2-chloro-6-methylphenyl)pyrazine-2-carboxamide
CID 107376052
5-amino-N-(2-chlorophenyl)pyrazine-2-carboxamide
CID 113381822
N-(2,6-difluorophenyl)-5-methylpyrazine-2-carboxamide
CID 51158953
5-amino-N-[(2-chlorophenyl)methyl]pyrazine-2-carboxamide
CID 113381834
5-amino-N-(2-bromo-4,6-difluorophenyl)pyrazine-2-carboxamide
CID 107374421
6-amino-N-(2,6-difluorophenyl)pyridine-3-carboxamide
CID 62155427
N-(2,3-dichlorophenyl)-5-(2,6-difluoroanilino)pyrazine-2-carboxamide
CID 109294623
(2S)-2-amino-N-(2-chloro-6-fluorophenyl)propanamide
CID 104877858
5-amino-N-(2-methylsulfanylphenyl)pyrazine-2-carboxamide
CID 113381839
5-amino-N-(3,5-dichloro-8λ4-thia-7,9-diazabicyclo[4.3.0]nona-1(6),2,4,7,8-pentaen-2-yl)pyrazine-2-carboxamide
CID 107375951

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide (CID 107377043) is 5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide is Nc1cnc(C(=O)Nc2c(F)cccc2Cl)cn1.
What is the InChIKey of 5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide?
The InChIKey is YCHMPZXKQYRPGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN4O/c12-6-2-1-3-7(13)10(6)17-11(18)8-4-16-9(14)5-15-8/h1-5H,(H2,14,16)(H,17,18).
What are the key properties of 5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide?
5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide has a molecular weight of 266.66 g/mol, XLogP of 2.10, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107377043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).