1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine

C13H19N5O — CID 166104701

IUPAC1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine
SMILESCOCCn1ncc2ncc(N3CCCCC3)nc21
InChIInChI=1S/C13H19N5O/c1-19-8-7-18-13-11(9-15-18)14-10-12(16-13)17-5-3-2-4-6-17/h9-10H,2-8H2,1H3
InChIKeyPQQUIECQIBGEMI-UHFFFAOYSA-N
MW261.33 g/mol
LogP1.46
Rot. Bonds4

About 1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine

1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine (PubChem CID 166104701) has the molecular formula C13H19N5O and a molecular weight of 261.33 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine
PubChem CID166104701
Molecular FormulaC13H19N5O
Molecular Weight261.33 g/mol
Exact Mass261.16
IUPAC Name1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine
SMILESCOCCn1ncc2ncc(N3CCCCC3)nc21
InChIInChI=1S/C13H19N5O/c1-19-8-7-18-13-11(9-15-18)14-10-12(16-13)17-5-3-2-4-6-17/h9-10H,2-8H2,1H3
InChIKeyPQQUIECQIBGEMI-UHFFFAOYSA-N
XLogP1.46
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-bromo-1-(2-methoxyethyl)pyrazolo[3,4-b]pyridine
CID 119087258
N-(2-methoxyethyl)-5-piperidin-1-yl-1,2,4-triazin-3-amine
CID 112941809
1-(2-methoxyethyl)-5-methylpyrazolo[4,5-b]pyridine
CID 177034392
2-[2-(2-methoxyethylamino)ethyl]-5-piperidin-1-ylpyridazin-3-one
CID 114397548
1-(2-methoxyethyl)-2-(2-methoxyethylamino)-5-methyl-7-piperidin-1-yl-1,8-naphthyridin-4-one
CID 20790380
4-(azepan-1-yl)-N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]pyrimidin-2-amine
CID 66903722
3-methoxy-2-(trifluoromethyl)pyridine;1-(3-methylcyclobutyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine
CID 166104726
2-methyl-6-piperidin-1-yl-[1,3]thiazolo[4,5-b]pyrazine
CID 14181153
5-(azepan-1-yl)-N-(3-methoxypropyl)pyrazine-2-carboxamide
CID 109276095
2-methoxy-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]ethanamine
CID 80628704
1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-2-methyl-2-piperidin-1-ylpropan-1-amine
CID 114656662
1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-2-methyl-2-piperidin-1-ylpropan-1-one
CID 114641095

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine?
The IUPAC name of 1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine (CID 166104701) is 1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine.
What is the SMILES notation for 1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine?
The canonical SMILES for 1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine is COCCn1ncc2ncc(N3CCCCC3)nc21.
What is the InChIKey of 1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine?
The InChIKey is PQQUIECQIBGEMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O/c1-19-8-7-18-13-11(9-15-18)14-10-12(16-13)17-5-3-2-4-6-17/h9-10H,2-8H2,1H3.
What are the key properties of 1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine?
1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine has a molecular weight of 261.33 g/mol, XLogP of 1.46, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-6-piperidin-1-ylpyrazolo[3,4-b]pyrazine is sourced from PubChem (CID 166104701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).