2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine

C13H17N5 — CID 124641432

IUPAC2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine
SMILESCn1cc(-c2nccnc2[C@@H]2CCCNC2)cn1
InChIInChI=1S/C13H17N5/c1-18-9-11(8-17-18)13-12(15-5-6-16-13)10-3-2-4-14-7-10/h5-6,8-10,14H,2-4,7H2,1H3/t10-/m1/s1
InChIKeyDGKGYXVUZRSMMZ-SNVBAGLBSA-N
MW243.31 g/mol
LogP1.34
Rot. Bonds2

About 2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine

2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine (PubChem CID 124641432) has the molecular formula C13H17N5 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine.

Molecular Properties

Compound Name2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine
PubChem CID124641432
Molecular FormulaC13H17N5
Molecular Weight243.31 g/mol
Exact Mass243.15
IUPAC Name2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine
SMILESCn1cc(-c2nccnc2[C@@H]2CCCNC2)cn1
InChIInChI=1S/C13H17N5/c1-18-9-11(8-17-18)13-12(15-5-6-16-13)10-3-2-4-14-7-10/h5-6,8-10,14H,2-4,7H2,1H3/t10-/m1/s1
InChIKeyDGKGYXVUZRSMMZ-SNVBAGLBSA-N
XLogP1.34
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-piperidin-3-yl-3-(1-propan-2-ylpyrazol-4-yl)pyrazine
CID 110102168
2-(1-methylpyrazol-4-yl)-4-piperidin-3-ylpyrazolo[1,5-a]pyrazine
CID 172552276
1-[(3R)-3-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 124989647
1-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95842023
5-(1-methylpyrazol-4-yl)-3-piperidin-3-yl-1,2,4-oxadiazole
CID 63024578
2,2-dimethyl-1-[(3S)-3-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]propan-1-one
CID 125000040
2-(2-methoxyphenyl)-3-[(3S)-piperidin-3-yl]pyrazine
CID 95816648
CID 164925744
CID 164925744
2-(2-fluorophenyl)-3-[(3R)-piperidin-3-yl]pyrazine
CID 95816643
2-(piperidin-3-ylmethyl)-3-(1-propylpyrazol-4-yl)pyrazine
CID 110102127
3-(1-methylpyrazol-4-yl)-2-pyrrolidin-3-ylimidazo[1,2-a]pyrazin-8-amine
CID 24864521
N-[1-[7-amino-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-6-yl]ethylidene]hydroxylamine
CID 91016821

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine?
The IUPAC name of 2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine (CID 124641432) is 2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine.
What is the SMILES notation for 2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine?
The canonical SMILES for 2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine is Cn1cc(-c2nccnc2[C@@H]2CCCNC2)cn1.
What is the InChIKey of 2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine?
The InChIKey is DGKGYXVUZRSMMZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H17N5/c1-18-9-11(8-17-18)13-12(15-5-6-16-13)10-3-2-4-14-7-10/h5-6,8-10,14H,2-4,7H2,1H3/t10-/m1/s1.
What are the key properties of 2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine?
2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine has a molecular weight of 243.31 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrazol-4-yl)-3-[(3R)-piperidin-3-yl]pyrazine is sourced from PubChem (CID 124641432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).