N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide

C21H23N5O2 — CID 71839394

IUPACN-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)C1CCCN(c2cnc3nccnc3c2)C1
InChIInChI=1S/C21H23N5O2/c1-2-28-19-8-4-3-7-17(19)25-21(27)15-6-5-11-26(14-15)16-12-18-20(24-13-16)23-10-9-22-18/h3-4,7-10,12-13,15H,2,5-6,11,14H2,1H3,(H,25,27)
InChIKeyFPNWNAHWALBNTN-UHFFFAOYSA-N
MW377.45 g/mol
LogP3.28
Rot. Bonds5

About N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide

N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide (PubChem CID 71839394) has the molecular formula C21H23N5O2 and a molecular weight of 377.45 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide
PubChem CID71839394
Molecular FormulaC21H23N5O2
Molecular Weight377.45 g/mol
Exact Mass377.19
IUPAC NameN-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)C1CCCN(c2cnc3nccnc3c2)C1
InChIInChI=1S/C21H23N5O2/c1-2-28-19-8-4-3-7-17(19)25-21(27)15-6-5-11-26(14-15)16-12-18-20(24-13-16)23-10-9-22-18/h3-4,7-10,12-13,15H,2,5-6,11,14H2,1H3,(H,25,27)
InChIKeyFPNWNAHWALBNTN-UHFFFAOYSA-N
XLogP3.28
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide (CID 71839394) is N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide is CCOc1ccccc1NC(=O)C1CCCN(c2cnc3nccnc3c2)C1.
What is the InChIKey of N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide?
The InChIKey is FPNWNAHWALBNTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O2/c1-2-28-19-8-4-3-7-17(19)25-21(27)15-6-5-11-26(14-15)16-12-18-20(24-13-16)23-10-9-22-18/h3-4,7-10,12-13,15H,2,5-6,11,14H2,1H3,(H,25,27).
What are the key properties of N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide?
N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide has a molecular weight of 377.45 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-3-carboxamide is sourced from PubChem (CID 71839394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).