N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide

C17H19FN4O — CID 109274738

IUPACN-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide
SMILESO=C(NC1CCCCC1)c1cnc(Nc2ccccc2F)cn1
InChIInChI=1S/C17H19FN4O/c18-13-8-4-5-9-14(13)22-16-11-19-15(10-20-16)17(23)21-12-6-2-1-3-7-12/h4-5,8-12H,1-3,6-7H2,(H,20,22)(H,21,23)
InChIKeyQGHDHFMCRBKUSH-UHFFFAOYSA-N
MW314.36 g/mol
LogP3.42
Rot. Bonds4

About N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide

N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide (PubChem CID 109274738) has the molecular formula C17H19FN4O and a molecular weight of 314.36 g/mol. Its IUPAC name is N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide
PubChem CID109274738
Molecular FormulaC17H19FN4O
Molecular Weight314.36 g/mol
Exact Mass314.15
IUPAC NameN-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide
SMILESO=C(NC1CCCCC1)c1cnc(Nc2ccccc2F)cn1
InChIInChI=1S/C17H19FN4O/c18-13-8-4-5-9-14(13)22-16-11-19-15(10-20-16)17(23)21-12-6-2-1-3-7-12/h4-5,8-12H,1-3,6-7H2,(H,20,22)(H,21,23)
InChIKeyQGHDHFMCRBKUSH-UHFFFAOYSA-N
XLogP3.42
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-5-(2-methylanilino)pyrazine-2-carboxamide
CID 109273966
5-(2-tert-butylanilino)-N-cycloheptylpyrazine-2-carboxamide
CID 109287489
N-cyclopropyl-5-(2,4-difluoroanilino)pyrazine-2-carboxamide
CID 109271723
5-(2-bromoanilino)-N-cyclopropylpyrazine-2-carboxamide
CID 109271713
N-cyclopentyl-5-[(2-fluorophenyl)methylamino]pyrazine-2-carboxamide
CID 109273905
ethyl 2-[[5-(cycloheptylcarbamoyl)pyrazin-2-yl]amino]benzoate
CID 109287547
5-[4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylpyrazine-2-carboxamide
CID 109274799
N-cyclohexyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274635
N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274884
N-cycloheptyl-2-(2-fluoroanilino)-6-methylpyrimidine-4-carboxamide
CID 109332952
5-[2-chloro-5-(trifluoromethyl)anilino]-N-cyclohexylpyrazine-2-carboxamide
CID 109274775
5-(cyclooctylcarbamoyl)pyrazine-2-carboxylic acid
CID 120684742

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide?
The IUPAC name of N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide (CID 109274738) is N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide is O=C(NC1CCCCC1)c1cnc(Nc2ccccc2F)cn1.
What is the InChIKey of N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide?
The InChIKey is QGHDHFMCRBKUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN4O/c18-13-8-4-5-9-14(13)22-16-11-19-15(10-20-16)17(23)21-12-6-2-1-3-7-12/h4-5,8-12H,1-3,6-7H2,(H,20,22)(H,21,23).
What are the key properties of N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide?
N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide has a molecular weight of 314.36 g/mol, XLogP of 3.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-(2-fluoroanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109274738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).