2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine

C18H21N5O — CID 120967209

IUPAC2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine
SMILESCOc1ccccc1C1CNCCN1Cc1cn2cccnc2n1
InChIInChI=1S/C18H21N5O/c1-24-17-6-3-2-5-15(17)16-11-19-8-10-22(16)12-14-13-23-9-4-7-20-18(23)21-14/h2-7,9,13,16,19H,8,10-12H2,1H3
InChIKeyGLSREBOBRIKPFY-UHFFFAOYSA-N
MW323.40 g/mol
LogP1.88
Rot. Bonds4

About 2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine

2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine (PubChem CID 120967209) has the molecular formula C18H21N5O and a molecular weight of 323.40 g/mol. Its IUPAC name is 2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine
PubChem CID120967209
Molecular FormulaC18H21N5O
Molecular Weight323.40 g/mol
Exact Mass323.17
IUPAC Name2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine
SMILESCOc1ccccc1C1CNCCN1Cc1cn2cccnc2n1
InChIInChI=1S/C18H21N5O/c1-24-17-6-3-2-5-15(17)16-11-19-8-10-22(16)12-14-13-23-9-4-7-20-18(23)21-14/h2-7,9,13,16,19H,8,10-12H2,1H3
InChIKeyGLSREBOBRIKPFY-UHFFFAOYSA-N
XLogP1.88
TPSA54.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine
CID 120753675
2-[[(2R)-2-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine;hydrochloride
CID 120966664
4-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]-N,N-dimethylpyrimidin-2-amine
CID 120767508
2-(2-methoxyphenyl)-1-[(6-methyl-2-pyridinyl)methyl]piperazine
CID 110109239
2-(2-methoxyphenyl)-1-[(1-methylimidazol-2-yl)methyl]piperazine;hydrochloride
CID 120767521
2-(2-methoxyphenyl)-1-[(5-methyl-2-pyridinyl)methyl]piperazine
CID 120767478
4-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]-1,3-thiazole;hydrochloride
CID 120767619
2-[[(2R)-2-(2-methoxyphenyl)piperazin-1-yl]methyl]-1,3-thiazole
CID 124943474
2-(2-methoxyphenyl)-1-(1H-pyrazol-5-ylmethyl)piperazine;hydrochloride
CID 120767431
1-[(5-bromo-2-pyridinyl)methyl]-2-(2-methoxyphenyl)piperazine;hydrochloride
CID 120767381
1-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(2-methoxyphenyl)piperazine
CID 120753443
2-(2-methoxyphenyl)-1-[(2-phenyltriazol-4-yl)methyl]piperazine
CID 120753605

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine?
The IUPAC name of 2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine (CID 120967209) is 2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine is COc1ccccc1C1CNCCN1Cc1cn2cccnc2n1.
What is the InChIKey of 2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine?
The InChIKey is GLSREBOBRIKPFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O/c1-24-17-6-3-2-5-15(17)16-11-19-8-10-22(16)12-14-13-23-9-4-7-20-18(23)21-14/h2-7,9,13,16,19H,8,10-12H2,1H3.
What are the key properties of 2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine?
2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine has a molecular weight of 323.40 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 120967209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).