[6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine

C14H18N6 — CID 62300156

IUPAC[6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine
SMILESNCc1cccc(N2CCN(c3ncccn3)CC2)n1
InChIInChI=1S/C14H18N6/c15-11-12-3-1-4-13(18-12)19-7-9-20(10-8-19)14-16-5-2-6-17-14/h1-6H,7-11,15H2
InChIKeyUERGJWCVSUGIJL-UHFFFAOYSA-N
MW270.34 g/mol
LogP0.66
Rot. Bonds3

About [6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine

[6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine (PubChem CID 62300156) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is [6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine
PubChem CID62300156
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC Name[6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine
SMILESNCc1cccc(N2CCN(c3ncccn3)CC2)n1
InChIInChI=1S/C14H18N6/c15-11-12-3-1-4-13(18-12)19-7-9-20(10-8-19)14-16-5-2-6-17-14/h1-6H,7-11,15H2
InChIKeyUERGJWCVSUGIJL-UHFFFAOYSA-N
XLogP0.66
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine?
The IUPAC name of [6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine (CID 62300156) is [6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine.
What is the SMILES notation for [6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine?
The canonical SMILES for [6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine is NCc1cccc(N2CCN(c3ncccn3)CC2)n1.
What is the InChIKey of [6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine?
The InChIKey is UERGJWCVSUGIJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6/c15-11-12-3-1-4-13(18-12)19-7-9-20(10-8-19)14-16-5-2-6-17-14/h1-6H,7-11,15H2.
What are the key properties of [6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine?
[6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine has a molecular weight of 270.34 g/mol, XLogP of 0.66, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridinyl]methanamine is sourced from PubChem (CID 62300156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).