1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol

C19H22N4O — CID 56771077

IUPAC1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol
SMILESCCc1ccc(-c2cc3c(N4CCCC(O)C4)nccn3n2)cc1
InChIInChI=1S/C19H22N4O/c1-2-14-5-7-15(8-6-14)17-12-18-19(20-9-11-23(18)21-17)22-10-3-4-16(24)13-22/h5-9,11-12,16,24H,2-4,10,13H2,1H3
InChIKeyDUBPCTPOQHHDNX-UHFFFAOYSA-N
MW322.41 g/mol
LogP2.92
Rot. Bonds3

About 1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol

1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol (PubChem CID 56771077) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is 1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol.

Molecular Properties

Compound Name1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol
PubChem CID56771077
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC Name1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol
SMILESCCc1ccc(-c2cc3c(N4CCCC(O)C4)nccn3n2)cc1
InChIInChI=1S/C19H22N4O/c1-2-14-5-7-15(8-6-14)17-12-18-19(20-9-11-23(18)21-17)22-10-3-4-16(24)13-22/h5-9,11-12,16,24H,2-4,10,13H2,1H3
InChIKeyDUBPCTPOQHHDNX-UHFFFAOYSA-N
XLogP2.92
TPSA53.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol?
The IUPAC name of 1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol (CID 56771077) is 1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol.
What is the SMILES notation for 1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol?
The canonical SMILES for 1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol is CCc1ccc(-c2cc3c(N4CCCC(O)C4)nccn3n2)cc1.
What is the InChIKey of 1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol?
The InChIKey is DUBPCTPOQHHDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c1-2-14-5-7-15(8-6-14)17-12-18-19(20-9-11-23(18)21-17)22-10-3-4-16(24)13-22/h5-9,11-12,16,24H,2-4,10,13H2,1H3.
What are the key properties of 1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol?
1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol has a molecular weight of 322.41 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-ol is sourced from PubChem (CID 56771077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).