2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine

C19H18N8 — CID 141293375

IUPAC2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine
SMILESc1ccc(N2CCN(c3ncc(-c4cnc5[nH]ccc5n4)cn3)CC2)nc1
InChIInChI=1S/C19H18N8/c1-2-5-20-17(3-1)26-7-9-27(10-8-26)19-23-11-14(12-24-19)16-13-22-18-15(25-16)4-6-21-18/h1-6,11-13H,7-10H2,(H,21,22)
InChIKeyDERNTDJKNYLAIW-UHFFFAOYSA-N
MW358.41 g/mol
LogP2.14
Rot. Bonds3

About 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine

2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine (PubChem CID 141293375) has the molecular formula C19H18N8 and a molecular weight of 358.41 g/mol. Its IUPAC name is 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine
PubChem CID141293375
Molecular FormulaC19H18N8
Molecular Weight358.41 g/mol
Exact Mass358.17
IUPAC Name2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine
SMILESc1ccc(N2CCN(c3ncc(-c4cnc5[nH]ccc5n4)cn3)CC2)nc1
InChIInChI=1S/C19H18N8/c1-2-5-20-17(3-1)26-7-9-27(10-8-26)19-23-11-14(12-24-19)16-13-22-18-15(25-16)4-6-21-18/h1-6,11-13H,7-10H2,(H,21,22)
InChIKeyDERNTDJKNYLAIW-UHFFFAOYSA-N
XLogP2.14
TPSA86.72 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.41
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine with MolForge

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Related Compounds

2-(4-methylphenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 150329888
2-(6-methyl-3-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine
CID 141293376
1-(4-fluorophenyl)-3-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]urea
CID 121112892
5-fluoro-2-methyl-N-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]benzenesulfonamide
CID 71790232
ethane;2-(2-methoxy-4-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine
CID 145168511
1-fluoro-4-pyridin-2-ylpiperazine
CID 143401045
2-(4-pyridin-2-ylpiperazin-1-yl)-5H-pyrimido[4,5-b][1,4]thiazin-6-one
CID 71005540
2-[4-(2-methylpyrazol-3-yl)phenyl]-5H-pyrrolo[2,3-b]pyrazine
CID 141340793
2-(4-fluorophenoxy)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]acetamide
CID 122300013
N-cyclopentyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide
CID 109249585
2-(4-pyridin-2-ylpiperazin-1-yl)quinazolin-4-amine
CID 4907991
1-chloro-4-pyridin-2-ylpiperazine
CID 130280526

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine (CID 141293375) is 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine is c1ccc(N2CCN(c3ncc(-c4cnc5[nH]ccc5n4)cn3)CC2)nc1.
What is the InChIKey of 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is DERNTDJKNYLAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N8/c1-2-5-20-17(3-1)26-7-9-27(10-8-26)19-23-11-14(12-24-19)16-13-22-18-15(25-16)4-6-21-18/h1-6,11-13H,7-10H2,(H,21,22).
What are the key properties of 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine?
2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 358.41 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]-5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 141293375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).