N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide

C19H17FN4O — CID 109291715

IUPACN-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide
SMILESCCN(C(=O)c1cnc(Nc2ccc(F)cc2)cn1)c1ccccc1
InChIInChI=1S/C19H17FN4O/c1-2-24(16-6-4-3-5-7-16)19(25)17-12-22-18(13-21-17)23-15-10-8-14(20)9-11-15/h3-13H,2H2,1H3,(H,22,23)
InChIKeyFPIIZGQFYJLBHD-UHFFFAOYSA-N
MW336.37 g/mol
LogP4.03
Rot. Bonds5

About N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide

N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide (PubChem CID 109291715) has the molecular formula C19H17FN4O and a molecular weight of 336.37 g/mol. Its IUPAC name is N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide
PubChem CID109291715
Molecular FormulaC19H17FN4O
Molecular Weight336.37 g/mol
Exact Mass336.14
IUPAC NameN-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide
SMILESCCN(C(=O)c1cnc(Nc2ccc(F)cc2)cn1)c1ccccc1
InChIInChI=1S/C19H17FN4O/c1-2-24(16-6-4-3-5-7-16)19(25)17-12-22-18(13-21-17)23-15-10-8-14(20)9-11-15/h3-13H,2H2,1H3,(H,22,23)
InChIKeyFPIIZGQFYJLBHD-UHFFFAOYSA-N
XLogP4.03
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-5-(3-fluoroanilino)-N-phenylpyrazine-2-carboxamide
CID 109291751
N-ethyl-5-[(4-fluorophenyl)methylamino]-N-phenylpyrazine-2-carboxamide
CID 109281723
5-(2,6-difluoroanilino)-N-ethyl-N-phenylpyrazine-2-carboxamide
CID 109291773
5-[4-(diethylamino)anilino]-N-methyl-N-phenylpyrazine-2-carboxamide
CID 109290262
N-ethyl-5-(3-methylanilino)-N-(3-methylphenyl)pyrazine-2-carboxamide
CID 109290010
5-(3-chloro-2-methylanilino)-N-ethyl-N-phenylpyrazine-2-carboxamide
CID 109291719
5-(4-acetylanilino)-N-ethyl-N-phenylpyridine-2-carboxamide
CID 109198507
N-ethyl-N-phenyl-5-(prop-2-enylamino)pyrazine-2-carboxamide
CID 109272245
5-(4-chloro-2-methylanilino)-N-ethyl-N-phenylpyrazine-2-carboxamide
CID 109291721
N-ethyl-5-(pentylamino)-N-phenylpyridine-2-carboxamide
CID 109195842
5-(benzylamino)-N-ethyl-N-phenylpyridine-2-carboxamide
CID 109188045
5-[(4-chlorophenyl)methylamino]-N-ethyl-N-phenylpyrazine-2-carboxamide
CID 109282125

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide?
The IUPAC name of N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide (CID 109291715) is N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide.
What is the SMILES notation for N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide?
The canonical SMILES for N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide is CCN(C(=O)c1cnc(Nc2ccc(F)cc2)cn1)c1ccccc1.
What is the InChIKey of N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide?
The InChIKey is FPIIZGQFYJLBHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN4O/c1-2-24(16-6-4-3-5-7-16)19(25)17-12-22-18(13-21-17)23-15-10-8-14(20)9-11-15/h3-13H,2H2,1H3,(H,22,23).
What are the key properties of N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide?
N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide has a molecular weight of 336.37 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(4-fluoroanilino)-N-phenylpyrazine-2-carboxamide is sourced from PubChem (CID 109291715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).