4-methyl-2-(piperazin-1-ylmethyl)pyrimidine

C10H16N4 — CID 63343078

IUPAC4-methyl-2-(piperazin-1-ylmethyl)pyrimidine
SMILESCc1ccnc(CN2CCNCC2)n1
InChIInChI=1S/C10H16N4/c1-9-2-3-12-10(13-9)8-14-6-4-11-5-7-14/h2-3,11H,4-8H2,1H3
InChIKeyCNIPZPCHSCNTDG-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.19
Rot. Bonds2

About 4-methyl-2-(piperazin-1-ylmethyl)pyrimidine

4-methyl-2-(piperazin-1-ylmethyl)pyrimidine (PubChem CID 63343078) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 4-methyl-2-(piperazin-1-ylmethyl)pyrimidine.

Molecular Properties

Compound Name4-methyl-2-(piperazin-1-ylmethyl)pyrimidine
PubChem CID63343078
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name4-methyl-2-(piperazin-1-ylmethyl)pyrimidine
SMILESCc1ccnc(CN2CCNCC2)n1
InChIInChI=1S/C10H16N4/c1-9-2-3-12-10(13-9)8-14-6-4-11-5-7-14/h2-3,11H,4-8H2,1H3
InChIKeyCNIPZPCHSCNTDG-UHFFFAOYSA-N
XLogP0.19
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(piperazin-1-ylmethyl)pyrimidine?
The IUPAC name of 4-methyl-2-(piperazin-1-ylmethyl)pyrimidine (CID 63343078) is 4-methyl-2-(piperazin-1-ylmethyl)pyrimidine.
What is the SMILES notation for 4-methyl-2-(piperazin-1-ylmethyl)pyrimidine?
The canonical SMILES for 4-methyl-2-(piperazin-1-ylmethyl)pyrimidine is Cc1ccnc(CN2CCNCC2)n1.
What is the InChIKey of 4-methyl-2-(piperazin-1-ylmethyl)pyrimidine?
The InChIKey is CNIPZPCHSCNTDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-9-2-3-12-10(13-9)8-14-6-4-11-5-7-14/h2-3,11H,4-8H2,1H3.
What are the key properties of 4-methyl-2-(piperazin-1-ylmethyl)pyrimidine?
4-methyl-2-(piperazin-1-ylmethyl)pyrimidine has a molecular weight of 192.27 g/mol, XLogP of 0.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(piperazin-1-ylmethyl)pyrimidine is sourced from PubChem (CID 63343078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).