[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol

C10H16N4O — CID 62748658

IUPAC[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol
SMILESCN1CCN(c2nccc(CO)n2)CC1
InChIInChI=1S/C10H16N4O/c1-13-4-6-14(7-5-13)10-11-3-2-9(8-15)12-10/h2-3,15H,4-8H2,1H3
InChIKeyGHXHYZOYODIPKC-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.28
Rot. Bonds2

About [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol

[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol (PubChem CID 62748658) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol.

Molecular Properties

Compound Name[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol
PubChem CID62748658
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol
SMILESCN1CCN(c2nccc(CO)n2)CC1
InChIInChI=1S/C10H16N4O/c1-13-4-6-14(7-5-13)10-11-3-2-9(8-15)12-10/h2-3,15H,4-8H2,1H3
InChIKeyGHXHYZOYODIPKC-UHFFFAOYSA-N
XLogP-0.28
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol?
The IUPAC name of [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol (CID 62748658) is [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol.
What is the SMILES notation for [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol?
The canonical SMILES for [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol is CN1CCN(c2nccc(CO)n2)CC1.
What is the InChIKey of [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol?
The InChIKey is GHXHYZOYODIPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-13-4-6-14(7-5-13)10-11-3-2-9(8-15)12-10/h2-3,15H,4-8H2,1H3.
What are the key properties of [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol?
[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol has a molecular weight of 208.26 g/mol, XLogP of -0.28, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanol is sourced from PubChem (CID 62748658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).