2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine

C15H21N5 — CID 110102168

IUPAC2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine
SMILESCC(C)n1cc(-c2nccnc2C2CCCNC2)cn1
InChIInChI=1S/C15H21N5/c1-11(2)20-10-13(9-19-20)15-14(17-6-7-18-15)12-4-3-5-16-8-12/h6-7,9-12,16H,3-5,8H2,1-2H3
InChIKeyTXTJCVZBERNGIO-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.39
Rot. Bonds3

About 2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine

2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine (PubChem CID 110102168) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine.

Molecular Properties

Compound Name2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine
PubChem CID110102168
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine
SMILESCC(C)n1cc(-c2nccnc2C2CCCNC2)cn1
InChIInChI=1S/C15H21N5/c1-11(2)20-10-13(9-19-20)15-14(17-6-7-18-15)12-4-3-5-16-8-12/h6-7,9-12,16H,3-5,8H2,1-2H3
InChIKeyTXTJCVZBERNGIO-UHFFFAOYSA-N
XLogP2.39
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine
CID 124641432
2-(piperidin-3-ylmethyl)-5-(1-propan-2-ylpyrazol-4-yl)pyrazine
CID 110102375
3-(4-chloro-1-propan-2-ylpyrazol-5-yl)piperidine
CID 83840007
2-(2-methoxyphenyl)-3-[(3S)-piperidin-3-yl]pyrazine
CID 95816648
2-(2-fluorophenyl)-3-[(3R)-piperidin-3-yl]pyrazine
CID 95816643
2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine
CID 172552276
3-piperidin-3-yl-N-pyrimidin-2-ylpyrazin-2-amine
CID 175661062
3-[1-(2-methylpropyl)pyrazol-4-yl]piperidine
CID 105461143
1-piperidin-3-yl-N-(1-propan-2-ylpyrazol-4-yl)methanesulfonamide
CID 62902333
N-(1-propan-2-ylpyrazol-4-yl)piperidine-3-sulfonamide
CID 62902334
(3S)-N-(1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide
CID 81139176
2-(piperidin-3-ylmethyl)-3-(1-propylpyrazol-4-yl)pyrazine
CID 110102127

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine?
The IUPAC name of 2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine (CID 110102168) is 2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine.
What is the SMILES notation for 2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine?
The canonical SMILES for 2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine is CC(C)n1cc(-c2nccnc2C2CCCNC2)cn1.
What is the InChIKey of 2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine?
The InChIKey is TXTJCVZBERNGIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-11(2)20-10-13(9-19-20)15-14(17-6-7-18-15)12-4-3-5-16-8-12/h6-7,9-12,16H,3-5,8H2,1-2H3.
What are the key properties of 2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine?
2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine has a molecular weight of 271.37 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine is sourced from PubChem (CID 110102168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).