2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine

C15H16N4 — CID 82298177

IUPAC2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
SMILESCc1ccc(-c2nc3ncccn3c2CCN)cc1
InChIInChI=1S/C15H16N4/c1-11-3-5-12(6-4-11)14-13(7-8-16)19-10-2-9-17-15(19)18-14/h2-6,9-10H,7-8,16H2,1H3
InChIKeyDJDXBEWAGXLALD-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.21
Rot. Bonds3

About 2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine

2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine (PubChem CID 82298177) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
PubChem CID82298177
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
SMILESCc1ccc(-c2nc3ncccn3c2CCN)cc1
InChIInChI=1S/C15H16N4/c1-11-3-5-12(6-4-11)14-13(7-8-16)19-10-2-9-17-15(19)18-14/h2-6,9-10H,7-8,16H2,1H3
InChIKeyDJDXBEWAGXLALD-UHFFFAOYSA-N
XLogP2.21
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(4-chlorophenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
CID 95475392
2-(2-phenylimidazo[1,2-a]pyrimidin-3-yl)ethanamine
CID 82292189
2-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
CID 82299531
3-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]propan-1-amine
CID 170879132
2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]acetic acid
CID 82304788
3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine
CID 69375800
[2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
CID 95474904
N-(4-chlorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 7338215
2-methyl-3-(4-methylphenyl)imidazo[1,2-a]pyrimidine
CID 71059779
N-[(4-methylphenyl)methyl]-2-phenylimidazo[1,2-a]pyrimidin-3-amine
CID 20952793
2-[2-(4-tert-butylphenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]ethanamine
CID 28866506
N-(2-methylphenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 3655160

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine?
The IUPAC name of 2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine (CID 82298177) is 2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine.
What is the SMILES notation for 2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine?
The canonical SMILES for 2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine is Cc1ccc(-c2nc3ncccn3c2CCN)cc1.
What is the InChIKey of 2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine?
The InChIKey is DJDXBEWAGXLALD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-11-3-5-12(6-4-11)14-13(7-8-16)19-10-2-9-17-15(19)18-14/h2-6,9-10H,7-8,16H2,1H3.
What are the key properties of 2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine?
2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine has a molecular weight of 252.32 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine is sourced from PubChem (CID 82298177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).