(6-piperazin-1-yl-3-pyridinyl)methanol

C10H15N3O — CID 23385573

IUPAC(6-piperazin-1-yl-3-pyridinyl)methanol
SMILESOCc1ccc(N2CCNCC2)nc1
InChIInChI=1S/C10H15N3O/c14-8-9-1-2-10(12-7-9)13-5-3-11-4-6-13/h1-2,7,11,14H,3-6,8H2
InChIKeyQXLKRHOSSUFVLX-UHFFFAOYSA-N
MW193.25 g/mol
LogP-0.02
Rot. Bonds2

About (6-piperazin-1-yl-3-pyridinyl)methanol

(6-piperazin-1-yl-3-pyridinyl)methanol (PubChem CID 23385573) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is (6-piperazin-1-yl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(6-piperazin-1-yl-3-pyridinyl)methanol
PubChem CID23385573
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name(6-piperazin-1-yl-3-pyridinyl)methanol
SMILESOCc1ccc(N2CCNCC2)nc1
InChIInChI=1S/C10H15N3O/c14-8-9-1-2-10(12-7-9)13-5-3-11-4-6-13/h1-2,7,11,14H,3-6,8H2
InChIKeyQXLKRHOSSUFVLX-UHFFFAOYSA-N
XLogP-0.02
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-piperazin-1-yl-3-pyridinyl)methanol?
The IUPAC name of (6-piperazin-1-yl-3-pyridinyl)methanol (CID 23385573) is (6-piperazin-1-yl-3-pyridinyl)methanol.
What is the SMILES notation for (6-piperazin-1-yl-3-pyridinyl)methanol?
The canonical SMILES for (6-piperazin-1-yl-3-pyridinyl)methanol is OCc1ccc(N2CCNCC2)nc1.
What is the InChIKey of (6-piperazin-1-yl-3-pyridinyl)methanol?
The InChIKey is QXLKRHOSSUFVLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c14-8-9-1-2-10(12-7-9)13-5-3-11-4-6-13/h1-2,7,11,14H,3-6,8H2.
What are the key properties of (6-piperazin-1-yl-3-pyridinyl)methanol?
(6-piperazin-1-yl-3-pyridinyl)methanol has a molecular weight of 193.25 g/mol, XLogP of -0.02, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-piperazin-1-yl-3-pyridinyl)methanol is sourced from PubChem (CID 23385573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).