5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide

C24H26N4O3 — CID 10194582

IUPAC5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide
SMILESCOc1ccc(-c2ncc(C(=O)NN3CCCCC3)nc2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H26N4O3/c1-30-19-10-6-17(7-11-19)22-23(18-8-12-20(31-2)13-9-18)26-21(16-25-22)24(29)27-28-14-4-3-5-15-28/h6-13,16H,3-5,14-15H2,1-2H3,(H,27,29)
InChIKeyCKIMQGCGMNRLMG-UHFFFAOYSA-N
MW418.50 g/mol
LogP3.96
Rot. Bonds6

About 5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide

5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide (PubChem CID 10194582) has the molecular formula C24H26N4O3 and a molecular weight of 418.50 g/mol. Its IUPAC name is 5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide
PubChem CID10194582
Molecular FormulaC24H26N4O3
Molecular Weight418.50 g/mol
Exact Mass418.20
IUPAC Name5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide
SMILESCOc1ccc(-c2ncc(C(=O)NN3CCCCC3)nc2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H26N4O3/c1-30-19-10-6-17(7-11-19)22-23(18-8-12-20(31-2)13-9-18)26-21(16-25-22)24(29)27-28-14-4-3-5-15-28/h6-13,16H,3-5,14-15H2,1-2H3,(H,27,29)
InChIKeyCKIMQGCGMNRLMG-UHFFFAOYSA-N
XLogP3.96
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.50
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Pyrazine-2-carboxylic acid 4-methoxy-benzylamide
CID 470910
5,6-bis(4-methoxyphenyl)-N-phenylpyrazine-2-carboxamide
CID 10216322
N-cyclohexyl-5,6-bis(4-methoxyphenyl)pyrazine-2-carboxamide
CID 10216436
N-(m-Tolyl)-6-(4-ethoxyphenyl)-pyrazine-2-carboxamide
CID 52947201
N'-(6-Ethoxy-1,2,3,4-tetrahydroacridin-9-yl)pyrazine-2-carbohydrazide
CID 50904396
N'-(7-ethoxy-2-methylquinolin-4-yl)pyrazine-2-carbohydrazide
CID 54583607
US10689357, Example 22
CID 146249093
N-[2-(4-methoxyphenyl)ethyl]-2-quinoxalinecarboxamide
CID 9265057
N'-[2-(4-methoxyphenyl)acetyl]pyrazine-2-carbohydrazide
CID 947821
N-[(4-methoxyphenyl)methyl]-5-methylpyrazine-2-carboxamide
CID 2531496
N-(6-methoxypyridin-3-yl)-N-methyl-5-o-tolylpyrazine-2-carboxamide
CID 46884414
N-ethyl-N-(6-methoxypyridin-3-yl)-5-o-tolylpyrazine-2-carboxamide
CID 46884437

Frequently Asked Questions

What is the IUPAC name of 5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide?
The IUPAC name of 5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide (CID 10194582) is 5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide.
What is the SMILES notation for 5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide?
The canonical SMILES for 5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide is COc1ccc(-c2ncc(C(=O)NN3CCCCC3)nc2-c2ccc(OC)cc2)cc1.
What is the InChIKey of 5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide?
The InChIKey is CKIMQGCGMNRLMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O3/c1-30-19-10-6-17(7-11-19)22-23(18-8-12-20(31-2)13-9-18)26-21(16-25-22)24(29)27-28-14-4-3-5-15-28/h6-13,16H,3-5,14-15H2,1-2H3,(H,27,29).
What are the key properties of 5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide?
5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide has a molecular weight of 418.50 g/mol, XLogP of 3.96, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(4-methoxyphenyl)-N-piperidin-1-ylpyrazine-2-carboxamide is sourced from PubChem (CID 10194582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).