2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine

C11H15N5 — CID 43162352

IUPAC2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine
SMILESc1cnc2nc(CN3CCNCC3)cn2c1
InChIInChI=1S/C11H15N5/c1-2-13-11-14-10(9-16(11)5-1)8-15-6-3-12-4-7-15/h1-2,5,9,12H,3-4,6-8H2
InChIKeyJPRFVGSGNNVXPR-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.13
Rot. Bonds2

About 2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine

2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine (PubChem CID 43162352) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine
PubChem CID43162352
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine
SMILESc1cnc2nc(CN3CCNCC3)cn2c1
InChIInChI=1S/C11H15N5/c1-2-13-11-14-10(9-16(11)5-1)8-15-6-3-12-4-7-15/h1-2,5,9,12H,3-4,6-8H2
InChIKeyJPRFVGSGNNVXPR-UHFFFAOYSA-N
XLogP0.13
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyrimidine
CID 65450164
[1-(imidazo[1,2-a]pyrimidin-2-ylmethyl)piperidin-4-yl]methanol
CID 60966758
N-(imidazo[1,2-a]pyrimidin-2-ylmethyl)-N-methyl-2-piperazin-1-ylethanamine
CID 63265435
(3S,4R)-1-(imidazo[1,2-a]pyrimidin-2-ylmethyl)pyrrolidine-3,4-diol
CID 79420023
2-[[(2R)-2-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine;hydrochloride
CID 120966664
1-(imidazo[1,2-a]pyrimidin-2-ylmethyl)-4-methylpiperidin-3-ol
CID 103897986
2-[[(2S,6R)-2,6-dimethylpiperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine
CID 120966976
ethyl 4-(imidazo[1,2-a]pyrimidin-2-ylmethyl)piperazine-1-carboxylate
CID 23962454
2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine
CID 71899063
1-(imidazo[1,2-a]pyrimidin-2-ylmethyl)-3,3-dimethylpiperidin-4-amine
CID 120967338
[4-(imidazo[1,2-a]pyrimidin-2-ylmethyl)morpholin-2-yl]methanamine;hydrochloride
CID 120966937
2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine
CID 120967209

Frequently Asked Questions

What is the IUPAC name of 2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine (CID 43162352) is 2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine is c1cnc2nc(CN3CCNCC3)cn2c1.
What is the InChIKey of 2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine?
The InChIKey is JPRFVGSGNNVXPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-2-13-11-14-10(9-16(11)5-1)8-15-6-3-12-4-7-15/h1-2,5,9,12H,3-4,6-8H2.
What are the key properties of 2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine?
2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine has a molecular weight of 217.28 g/mol, XLogP of 0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 43162352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).