1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone

C14H19N5O2 — CID 167923541

IUPAC1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone
SMILESO=C(Cn1cc2ncccc2n1)N1CCN(CCO)CC1
InChIInChI=1S/C14H19N5O2/c20-9-8-17-4-6-18(7-5-17)14(21)11-19-10-13-12(16-19)2-1-3-15-13/h1-3,10,20H,4-9,11H2
InChIKeyGWHWOQHFTHWDOU-UHFFFAOYSA-N
MW289.34 g/mol
LogP-0.43
Rot. Bonds4

About 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone

1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone (PubChem CID 167923541) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone.

Molecular Properties

Compound Name1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone
PubChem CID167923541
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone
SMILESO=C(Cn1cc2ncccc2n1)N1CCN(CCO)CC1
InChIInChI=1S/C14H19N5O2/c20-9-8-17-4-6-18(7-5-17)14(21)11-19-10-13-12(16-19)2-1-3-15-13/h1-3,10,20H,4-9,11H2
InChIKeyGWHWOQHFTHWDOU-UHFFFAOYSA-N
XLogP-0.43
TPSA74.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-pyrazolo[4,3-b]pyridin-2-ylacetic acid;dihydrochloride
CID 136575559
1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrimidin-2-yloxyethanone
CID 121086683
1-[4-[6-[4-(2-hydroxyethyl)piperazin-1-yl]pyridazin-3-yl]piperazin-1-yl]-2-(1,2,4-triazol-1-yl)ethanone
CID 122336760
[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl] pyridine-3-carboxylate
CID 23802850
1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyridin-4-ylethanone
CID 43501406
2-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone
CID 118225627
5-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl]pyrido[2,3-b][1,4]benzothiazepin-6-one;hydrochloride
CID 75488751
1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyrazol-1-ylpropan-1-one
CID 43501387
5-amino-1-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl]pyridin-2-one
CID 62816340
2-pyrazol-1-yl-1-[4-(2-pyrazol-1-ylethyl)piperazin-1-yl]ethanone
CID 90508652
2-(benzotriazol-2-yl)-1-[4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-1-yl]ethanone
CID 70724671
[4-(2-hydroxyethyl)piperazin-1-yl]-pyridin-3-ylmethanone
CID 3268876

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone?
The IUPAC name of 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone (CID 167923541) is 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone.
What is the SMILES notation for 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone?
The canonical SMILES for 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone is O=C(Cn1cc2ncccc2n1)N1CCN(CCO)CC1.
What is the InChIKey of 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone?
The InChIKey is GWHWOQHFTHWDOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c20-9-8-17-4-6-18(7-5-17)14(21)11-19-10-13-12(16-19)2-1-3-15-13/h1-3,10,20H,4-9,11H2.
What are the key properties of 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone?
1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone has a molecular weight of 289.34 g/mol, XLogP of -0.43, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyrazolo[4,3-b]pyridin-2-ylethanone is sourced from PubChem (CID 167923541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).