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

C22H24N4O3 — CID 109293748

IUPAC5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
SMILESCCOc1ccc(Nc2cnc(C(=O)Nc3ccccc3OC(C)C)cn2)cc1
InChIInChI=1S/C22H24N4O3/c1-4-28-17-11-9-16(10-12-17)25-21-14-23-19(13-24-21)22(27)26-18-7-5-6-8-20(18)29-15(2)3/h5-15H,4H2,1-3H3,(H,24,25)(H,26,27)
InChIKeyIKKPONFPNMIJIB-UHFFFAOYSA-N
MW392.46 g/mol
LogP4.66
Rot. Bonds8

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

5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide (PubChem CID 109293748) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is 5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
PubChem CID109293748
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC Name5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
SMILESCCOc1ccc(Nc2cnc(C(=O)Nc3ccccc3OC(C)C)cn2)cc1
InChIInChI=1S/C22H24N4O3/c1-4-28-17-11-9-16(10-12-17)25-21-14-23-19(13-24-21)22(27)26-18-7-5-6-8-20(18)29-15(2)3/h5-15H,4H2,1-3H3,(H,24,25)(H,26,27)
InChIKeyIKKPONFPNMIJIB-UHFFFAOYSA-N
XLogP4.66
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(4-methoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293616
5-[4-(dimethylamino)anilino]-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293832
5-(4-ethoxyanilino)-N-phenylpyrazine-2-carboxamide
CID 109289463
N-(2-ethylphenyl)-5-(4-propan-2-yloxyanilino)pyrazine-2-carboxamide
CID 109291492
5-(4-propan-2-yloxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109291937
5-(3-methoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293523
5-(4-tert-butylanilino)-N-(2-ethoxyphenyl)pyrazine-2-carboxamide
CID 109292315
5-(3-cyanoanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293839
methyl 4-[[5-[(2-ethoxyphenyl)carbamoyl]pyrazin-2-yl]amino]benzoate
CID 109293673
N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide
CID 109293614
5-(2-ethoxyanilino)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109292013
5-(4-methoxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109291932

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide (CID 109293748) is 5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide is CCOc1ccc(Nc2cnc(C(=O)Nc3ccccc3OC(C)C)cn2)cc1.
What is the InChIKey of 5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide?
The InChIKey is IKKPONFPNMIJIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-4-28-17-11-9-16(10-12-17)25-21-14-23-19(13-24-21)22(27)26-18-7-5-6-8-20(18)29-15(2)3/h5-15H,4H2,1-3H3,(H,24,25)(H,26,27).
What are the key properties of 5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide?
5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide has a molecular weight of 392.46 g/mol, XLogP of 4.66, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109293748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).