5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide

C22H24N4O2 — CID 109292013

IUPAC5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide
SMILESCCOc1ccccc1Nc1cnc(C(=O)Nc2ccc(C(C)C)cc2)cn1
InChIInChI=1S/C22H24N4O2/c1-4-28-20-8-6-5-7-18(20)26-21-14-23-19(13-24-21)22(27)25-17-11-9-16(10-12-17)15(2)3/h5-15H,4H2,1-3H3,(H,24,26)(H,25,27)
InChIKeyDODPCMDTDJRSLO-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.99
Rot. Bonds7

About 5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide

5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide (PubChem CID 109292013) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide
PubChem CID109292013
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide
SMILESCCOc1ccccc1Nc1cnc(C(=O)Nc2ccc(C(C)C)cc2)cn1
InChIInChI=1S/C22H24N4O2/c1-4-28-20-8-6-5-7-18(20)26-21-14-23-19(13-24-21)22(27)25-17-11-9-16(10-12-17)15(2)3/h5-15H,4H2,1-3H3,(H,24,26)(H,25,27)
InChIKeyDODPCMDTDJRSLO-UHFFFAOYSA-N
XLogP4.99
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-ethoxyanilino)-N-(4-methylphenyl)pyrazine-2-carboxamide
CID 109290053
5-(2-ethoxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109291933
methyl 2-[[5-[(4-propan-2-ylphenyl)carbamoyl]pyrazin-2-yl]amino]benzoate
CID 109292025
N-(2-tert-butylphenyl)-5-(2-ethoxyanilino)pyrazine-2-carboxamide
CID 109292240
5-(4-tert-butylanilino)-N-(2-ethoxyphenyl)pyrazine-2-carboxamide
CID 109292315
5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293748
methyl 4-[[5-[(2-ethoxyphenyl)carbamoyl]pyrazin-2-yl]amino]benzoate
CID 109293673
5-(butan-2-ylamino)-N-(2-ethoxyphenyl)pyrazine-2-carboxamide
CID 109273434
N-(2-fluorophenyl)-5-(4-propan-2-ylanilino)pyrazine-2-carboxamide
CID 109292042
5-(5-chloro-2-methoxyanilino)-N-(2-ethoxyphenyl)pyrazine-2-carboxamide
CID 109293339
5-(2-chloroanilino)-N-(4-ethylphenyl)pyrazine-2-carboxamide
CID 109291594
5-(2-ethoxyanilino)-N,N-diethylpyrazine-2-carboxamide
CID 109286788

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide (CID 109292013) is 5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide is CCOc1ccccc1Nc1cnc(C(=O)Nc2ccc(C(C)C)cc2)cn1.
What is the InChIKey of 5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide?
The InChIKey is DODPCMDTDJRSLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-4-28-20-8-6-5-7-18(20)26-21-14-23-19(13-24-21)22(27)25-17-11-9-16(10-12-17)15(2)3/h5-15H,4H2,1-3H3,(H,24,26)(H,25,27).
What are the key properties of 5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide?
5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 4.99, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109292013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).