N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide

C22H23N5O2 — CID 109285572

IUPACN-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide
SMILESCOc1cccc(NC(=O)c2cnc(N3CCN(c4ccccc4)CC3)cn2)c1
InChIInChI=1S/C22H23N5O2/c1-29-19-9-5-6-17(14-19)25-22(28)20-15-24-21(16-23-20)27-12-10-26(11-13-27)18-7-3-2-4-8-18/h2-9,14-16H,10-13H2,1H3,(H,25,28)
InChIKeySCLPDTSZEQSYDI-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.06
Rot. Bonds5

About N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide

N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide (PubChem CID 109285572) has the molecular formula C22H23N5O2 and a molecular weight of 389.46 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide
PubChem CID109285572
Molecular FormulaC22H23N5O2
Molecular Weight389.46 g/mol
Exact Mass389.19
IUPAC NameN-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide
SMILESCOc1cccc(NC(=O)c2cnc(N3CCN(c4ccccc4)CC3)cn2)c1
InChIInChI=1S/C22H23N5O2/c1-29-19-9-5-6-17(14-19)25-22(28)20-15-24-21(16-23-20)27-12-10-26(11-13-27)18-7-3-2-4-8-18/h2-9,14-16H,10-13H2,1H3,(H,25,28)
InChIKeySCLPDTSZEQSYDI-UHFFFAOYSA-N
XLogP3.06
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(4-acetylpiperazin-1-yl)-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 109279251
N-(2,6-dimethylphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109285561
N-(3-methoxyphenyl)-4-phenylpiperazine-1-carboxamide
CID 6469276
N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203921
methyl 3-[(5-piperidin-1-ylpyrazine-2-carbonyl)amino]benzoate
CID 109274586
N-(3-methylphenyl)-5-(4-pyridin-2-ylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109286617
5-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide
CID 109289419
N-(3-acetylphenyl)-5-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109278366
N-(3-methoxyphenyl)isoquinoline-3-carboxamide
CID 110859992
N-(3-chlorophenyl)-5-(4-pyridin-2-ylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109286633
5-hydrazinyl-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 107377927
N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
CID 109215246

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide (CID 109285572) is N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide is COc1cccc(NC(=O)c2cnc(N3CCN(c4ccccc4)CC3)cn2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide?
The InChIKey is SCLPDTSZEQSYDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O2/c1-29-19-9-5-6-17(14-19)25-22(28)20-15-24-21(16-23-20)27-12-10-26(11-13-27)18-7-3-2-4-8-18/h2-9,14-16H,10-13H2,1H3,(H,25,28).
What are the key properties of N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide?
N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 109285572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).