5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide

C22H23N5O2 — CID 109278397

IUPAC5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide
SMILESCN1CCN(c2cnc(C(=O)Nc3ccccc3Oc3ccccc3)cn2)CC1
InChIInChI=1S/C22H23N5O2/c1-26-11-13-27(14-12-26)21-16-23-19(15-24-21)22(28)25-18-9-5-6-10-20(18)29-17-7-3-2-4-8-17/h2-10,15-16H,11-14H2,1H3,(H,25,28)
InChIKeyMKBPIUMPZFLGTD-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.27
Rot. Bonds5

About 5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide

5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide (PubChem CID 109278397) has the molecular formula C22H23N5O2 and a molecular weight of 389.46 g/mol. Its IUPAC name is 5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide
PubChem CID109278397
Molecular FormulaC22H23N5O2
Molecular Weight389.46 g/mol
Exact Mass389.19
IUPAC Name5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide
SMILESCN1CCN(c2cnc(C(=O)Nc3ccccc3Oc3ccccc3)cn2)CC1
InChIInChI=1S/C22H23N5O2/c1-26-11-13-27(14-12-26)21-16-23-19(15-24-21)22(28)25-18-9-5-6-10-20(18)29-17-7-3-2-4-8-17/h2-10,15-16H,11-14H2,1H3,(H,25,28)
InChIKeyMKBPIUMPZFLGTD-UHFFFAOYSA-N
XLogP3.27
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 ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109273814
5-(azepan-1-yl)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109289350
5-(4-formylpiperazin-1-yl)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109278980
N-(2,4-dichlorophenyl)-5-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109278402
N-(5-chloro-2-methylphenyl)-5-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109278343
(4-methylpiperazin-1-yl)-[5-(2-phenoxyanilino)pyrazin-2-yl]methanone
CID 109278224
N-(3-methoxyphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109285572
5-(4-formylpiperazin-1-yl)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109278953
5-(4-methylpiperazin-1-yl)pyrazine-2-carboxylic acid;dihydrochloride
CID 170916735
N-(3-acetylphenyl)-5-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109278366
N-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109273799
N-(3,5-dimethylphenyl)-5-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109278323

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide (CID 109278397) is 5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide is CN1CCN(c2cnc(C(=O)Nc3ccccc3Oc3ccccc3)cn2)CC1.
What is the InChIKey of 5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide?
The InChIKey is MKBPIUMPZFLGTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O2/c1-26-11-13-27(14-12-26)21-16-23-19(15-24-21)22(28)25-18-9-5-6-10-20(18)29-17-7-3-2-4-8-17/h2-10,15-16H,11-14H2,1H3,(H,25,28).
What are the key properties of 5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide?
5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109278397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).