4-(Piperazin-1-yl)pyridin-2-ol hydrobromide

C9H14BrN3O — CID 139026493

IUPAC4-piperazin-1-yl-1H-pyridin-2-one;hydrobromide
SMILESC1CN(CCN1)C2=CC(=O)NC=C2.Br
InChIInChI=1S/C9H13N3O.BrH/c13-9-7-8(1-2-11-9)12-5-3-10-4-6-12;/h1-2,7,10H,3-6H2,(H,11,13);1H
InChIKeyNIVVHDAKBXFTBK-UHFFFAOYSA-N
MW260.13 g/mol
LogP—
Rot. Bonds1

About 4-(Piperazin-1-yl)pyridin-2-ol hydrobromide

4-(Piperazin-1-yl)pyridin-2-ol hydrobromide (PubChem CID 139026493) has the molecular formula C9H14BrN3O and a molecular weight of 260.13 g/mol. Its IUPAC name is 4-piperazin-1-yl-1H-pyridin-2-one;hydrobromide.

Molecular Properties

Compound Name4-(Piperazin-1-yl)pyridin-2-ol hydrobromide
PubChem CID139026493
Molecular FormulaC9H14BrN3O
Molecular Weight260.13 g/mol
Exact Mass259.03
IUPAC Name4-piperazin-1-yl-1H-pyridin-2-one;hydrobromide
SMILESC1CN(CCN1)C2=CC(=O)NC=C2.Br
InChIInChI=1S/C9H13N3O.BrH/c13-9-7-8(1-2-11-9)12-5-3-10-4-6-12;/h1-2,7,10H,3-6H2,(H,11,13);1H
InChIKeyNIVVHDAKBXFTBK-UHFFFAOYSA-N
XLogP—
TPSA44.40 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity264

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(Piperazin-1-yl)pyridin-2-ol hydrobromide?
The IUPAC name of 4-(Piperazin-1-yl)pyridin-2-ol hydrobromide (CID 139026493) is 4-piperazin-1-yl-1H-pyridin-2-one;hydrobromide.
What is the SMILES notation for 4-(Piperazin-1-yl)pyridin-2-ol hydrobromide?
The canonical SMILES for 4-(Piperazin-1-yl)pyridin-2-ol hydrobromide is C1CN(CCN1)C2=CC(=O)NC=C2.Br.
What is the InChIKey of 4-(Piperazin-1-yl)pyridin-2-ol hydrobromide?
The InChIKey is NIVVHDAKBXFTBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O.BrH/c13-9-7-8(1-2-11-9)12-5-3-10-4-6-12;/h1-2,7,10H,3-6H2,(H,11,13);1H.
What are the key properties of 4-(Piperazin-1-yl)pyridin-2-ol hydrobromide?
4-(Piperazin-1-yl)pyridin-2-ol hydrobromide has a molecular weight of 260.13 g/mol, XLogP of not available, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(Piperazin-1-yl)pyridin-2-ol hydrobromide is sourced from PubChem (CID 139026493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).