[4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol

C16H20N4O — CID 131914452

IUPAC[4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol
SMILESOCc1cc(N2CCN(Cc3ccccn3)CC2)ccn1
InChIInChI=1S/C16H20N4O/c21-13-15-11-16(4-6-18-15)20-9-7-19(8-10-20)12-14-3-1-2-5-17-14/h1-6,11,21H,7-10,12-13H2
InChIKeyAZUCQYFPKKSBRM-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.29
Rot. Bonds4

About [4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol

[4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol (PubChem CID 131914452) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is [4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol
PubChem CID131914452
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name[4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol
SMILESOCc1cc(N2CCN(Cc3ccccn3)CC2)ccn1
InChIInChI=1S/C16H20N4O/c21-13-15-11-16(4-6-18-15)20-9-7-19(8-10-20)12-14-3-1-2-5-17-14/h1-6,11,21H,7-10,12-13H2
InChIKeyAZUCQYFPKKSBRM-UHFFFAOYSA-N
XLogP1.29
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]pyridine-2-carbonitrile
CID 171149738
1-phenyl-4-(pyridin-2-ylmethyl)piperazine
CID 1090338
(4-pyrrolidin-1-yl-2-pyridinyl)methanol
CID 61253003
[4-(4-benzylpiperazin-1-yl)-2-pyridinyl]methanamine
CID 62299103
1-(4-methoxyphenyl)-4-(pyridin-2-ylmethyl)piperazine
CID 134032862
2-chloro-4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]benzonitrile
CID 71978279
[4-(3,6-dihydro-2H-pyridin-1-yl)-2-pyridinyl]methanol
CID 114412365
4-(4-benzylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 109212679
1-(pyridin-2-ylmethyl)-4-(2,2,2-trifluoroethyl)piperazine
CID 171700809
2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]aniline
CID 19626880
[4-(1,4-oxazepan-4-yl)-2-pyridinyl]methanol
CID 62973119
1-(2-methylprop-2-enyl)-4-(pyridin-2-ylmethyl)piperazine
CID 134055422

Frequently Asked Questions

What is the IUPAC name of [4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol?
The IUPAC name of [4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol (CID 131914452) is [4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol.
What is the SMILES notation for [4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol?
The canonical SMILES for [4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol is OCc1cc(N2CCN(Cc3ccccn3)CC2)ccn1.
What is the InChIKey of [4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol?
The InChIKey is AZUCQYFPKKSBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c21-13-15-11-16(4-6-18-15)20-9-7-19(8-10-20)12-14-3-1-2-5-17-14/h1-6,11,21H,7-10,12-13H2.
What are the key properties of [4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol?
[4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol has a molecular weight of 284.36 g/mol, XLogP of 1.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-2-pyridinyl]methanol is sourced from PubChem (CID 131914452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).