2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine

C15H21N5 — CID 124942689

IUPAC2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine
SMILESCCCn1nccc1-c1cnc(C[C@H]2CCNC2)cn1
InChIInChI=1S/C15H21N5/c1-2-7-20-15(4-6-19-20)14-11-17-13(10-18-14)8-12-3-5-16-9-12/h4,6,10-12,16H,2-3,5,7-9H2,1H3/t12-/m1/s1
InChIKeyAXBFCUYRJSDLAW-GFCCVEGCSA-N
MW271.37 g/mol
LogP1.90
Rot. Bonds5

About 2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine

2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine (PubChem CID 124942689) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine.

Molecular Properties

Compound Name2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine
PubChem CID124942689
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine
SMILESCCCn1nccc1-c1cnc(C[C@H]2CCNC2)cn1
InChIInChI=1S/C15H21N5/c1-2-7-20-15(4-6-19-20)14-11-17-13(10-18-14)8-12-3-5-16-9-12/h4,6,10-12,16H,2-3,5,7-9H2,1H3/t12-/m1/s1
InChIKeyAXBFCUYRJSDLAW-GFCCVEGCSA-N
XLogP1.90
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[(3S)-piperidin-3-yl]methyl]-5-(2-propylpyrazol-3-yl)pyrazine
CID 124976993
1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole
CID 114557866
2-(3-methylimidazol-4-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine
CID 124641985
2-(2-ethylpyrazol-3-yl)-5-[[(3S)-1-methylpyrrolidin-3-yl]methyl]pyrazine
CID 125013738
4-(piperidin-4-ylmethyl)-2-(2-propylpyrazol-3-yl)pyridine
CID 110102012
2-[[(3R)-piperidin-3-yl]methyl]-5-(1-propylpyrazol-4-yl)pyrazine
CID 124968977
2-methyl-5-[[(3S)-pyrrolidin-3-yl]methyl]pyrazine
CID 157065422
2-[[(3R)-pyrrolidin-3-yl]methyl]-5-(1,3,5-trimethylpyrazol-4-yl)pyrazine
CID 125017846
5-[(1-methylpyrrolidin-3-yl)methyl]-2-(2-propylpyrazol-3-yl)pyridine
CID 110102056
5-[(1-methylsulfonylpiperidin-4-yl)methyl]-2-(2-propylpyrazol-3-yl)pyridine
CID 110102092
2-(piperidin-3-ylmethyl)-5-(1-propan-2-ylpyrazol-4-yl)pyrazine
CID 110102375
4-(2-propan-2-ylpyrazol-3-yl)-6-(pyrrolidin-3-ylmethyl)pyrimidine
CID 110101288

Frequently Asked Questions

What is the IUPAC name of 2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine?
The IUPAC name of 2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine (CID 124942689) is 2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine.
What is the SMILES notation for 2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine?
The canonical SMILES for 2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine is CCCn1nccc1-c1cnc(C[C@H]2CCNC2)cn1.
What is the InChIKey of 2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine?
The InChIKey is AXBFCUYRJSDLAW-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H21N5/c1-2-7-20-15(4-6-19-20)14-11-17-13(10-18-14)8-12-3-5-16-9-12/h4,6,10-12,16H,2-3,5,7-9H2,1H3/t12-/m1/s1.
What are the key properties of 2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine?
2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine has a molecular weight of 271.37 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine is sourced from PubChem (CID 124942689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).