5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide

C22H19N5O — CID 109291574

IUPAC5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
SMILESCCc1ccccc1Nc1cnc(C(=O)Nc2cccc3cccnc23)cn1
InChIInChI=1S/C22H19N5O/c1-2-15-7-3-4-10-17(15)26-20-14-24-19(13-25-20)22(28)27-18-11-5-8-16-9-6-12-23-21(16)18/h3-14H,2H2,1H3,(H,25,26)(H,27,28)
InChIKeyYAMSETGOIOOLLC-UHFFFAOYSA-N
MW369.43 g/mol
LogP4.58
Rot. Bonds5

About 5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide

5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide (PubChem CID 109291574) has the molecular formula C22H19N5O and a molecular weight of 369.43 g/mol. Its IUPAC name is 5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
PubChem CID109291574
Molecular FormulaC22H19N5O
Molecular Weight369.43 g/mol
Exact Mass369.16
IUPAC Name5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
SMILESCCc1ccccc1Nc1cnc(C(=O)Nc2cccc3cccnc23)cn1
InChIInChI=1S/C22H19N5O/c1-2-15-7-3-4-10-17(15)26-20-14-24-19(13-25-20)22(28)27-18-11-5-8-16-9-6-12-23-21(16)18/h3-14H,2H2,1H3,(H,25,26)(H,27,28)
InChIKeyYAMSETGOIOOLLC-UHFFFAOYSA-N
XLogP4.58
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2,6-dimethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109291330
5-[(2-methylphenyl)methylamino]-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109280202
N-(2-methoxyphenyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide
CID 109293403
5-(2-methylpropylamino)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109273088
5-(2,3-dimethylanilino)-N-(2-ethylphenyl)pyrazine-2-carboxamide
CID 109291406
N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide
CID 109291580
N-propan-2-yl-5-(quinolin-8-ylamino)pyrazine-2-carboxamide
CID 109271325
5-(3-chloro-4-methylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109293181
5-chloro-N-quinolin-8-ylpyrazine-2-carboxamide
CID 103817057
N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide
CID 109280869
5-(3,5-dimethylanilino)-N-(2-ethylphenyl)pyrazine-2-carboxamide
CID 109291158
5-(4-bromoanilino)-N-(2-ethylphenyl)pyrazine-2-carboxamide
CID 109291484

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide?
The IUPAC name of 5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide (CID 109291574) is 5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide?
The canonical SMILES for 5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide is CCc1ccccc1Nc1cnc(C(=O)Nc2cccc3cccnc23)cn1.
What is the InChIKey of 5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide?
The InChIKey is YAMSETGOIOOLLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O/c1-2-15-7-3-4-10-17(15)26-20-14-24-19(13-25-20)22(28)27-18-11-5-8-16-9-6-12-23-21(16)18/h3-14H,2H2,1H3,(H,25,26)(H,27,28).
What are the key properties of 5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide?
5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide has a molecular weight of 369.43 g/mol, XLogP of 4.58, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide is sourced from PubChem (CID 109291574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).