[6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine

C14H14N4 — CID 117000165

IUPAC[6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine
SMILESCc1ccccc1-c1cnc2nc(CN)cn2c1
InChIInChI=1S/C14H14N4/c1-10-4-2-3-5-13(10)11-7-16-14-17-12(6-15)9-18(14)8-11/h2-5,7-9H,6,15H2,1H3
InChIKeyOBRNNJGIHIRLJT-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.16
Rot. Bonds2

About [6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine

[6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine (PubChem CID 117000165) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is [6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine.

Molecular Properties

Compound Name[6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine
PubChem CID117000165
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name[6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine
SMILESCc1ccccc1-c1cnc2nc(CN)cn2c1
InChIInChI=1S/C14H14N4/c1-10-4-2-3-5-13(10)11-7-16-14-17-12(6-15)9-18(14)8-11/h2-5,7-9H,6,15H2,1H3
InChIKeyOBRNNJGIHIRLJT-UHFFFAOYSA-N
XLogP2.16
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine?
The IUPAC name of [6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine (CID 117000165) is [6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine.
What is the SMILES notation for [6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine?
The canonical SMILES for [6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine is Cc1ccccc1-c1cnc2nc(CN)cn2c1.
What is the InChIKey of [6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine?
The InChIKey is OBRNNJGIHIRLJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-10-4-2-3-5-13(10)11-7-16-14-17-12(6-15)9-18(14)8-11/h2-5,7-9H,6,15H2,1H3.
What are the key properties of [6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine?
[6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine has a molecular weight of 238.29 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-methylphenyl)imidazo[1,2-a]pyrimidin-2-yl]methanamine is sourced from PubChem (CID 117000165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).