[2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine

C16H18N4 — CID 82304501

IUPAC[2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
SMILESCc1cc(C)c(-c2nc3ncccn3c2CN)cc1C
InChIInChI=1S/C16H18N4/c1-10-7-12(3)13(8-11(10)2)15-14(9-17)20-6-4-5-18-16(20)19-15/h4-8H,9,17H2,1-3H3
InChIKeyQZFMQZCVUGZWJI-UHFFFAOYSA-N
MW266.35 g/mol
LogP2.78
Rot. Bonds2

About [2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine

[2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine (PubChem CID 82304501) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is [2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
PubChem CID82304501
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name[2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
SMILESCc1cc(C)c(-c2nc3ncccn3c2CN)cc1C
InChIInChI=1S/C16H18N4/c1-10-7-12(3)13(8-11(10)2)15-14(9-17)20-6-4-5-18-16(20)19-15/h4-8H,9,17H2,1-3H3
InChIKeyQZFMQZCVUGZWJI-UHFFFAOYSA-N
XLogP2.78
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
CID 95474904
2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
CID 82298177
2-(4-ethoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine-3-carbaldehyde
CID 82135013
2-(2-phenylimidazo[1,2-a]pyrimidin-3-yl)ethanamine
CID 82292189
2-[2-(4-chlorophenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
CID 95475392
N-methyl-1-(2-methylimidazo[1,2-a]pyrimidin-3-yl)methanamine
CID 83827625
2-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
CID 82299531
2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]acetic acid
CID 82304788
2-(furan-2-yl)-3-methylimidazo[1,2-a]pyrimidine
CID 115403452
3-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]propan-1-amine
CID 170879132
(5-methylimidazo[1,2-a]pyrimidin-7-yl)methanamine
CID 117274860
2-(2,4-dimethoxyphenyl)imidazo[1,2-a]pyrimidin-3-amine;hydrochloride
CID 70046984

Frequently Asked Questions

What is the IUPAC name of [2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine?
The IUPAC name of [2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine (CID 82304501) is [2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine.
What is the SMILES notation for [2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine?
The canonical SMILES for [2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine is Cc1cc(C)c(-c2nc3ncccn3c2CN)cc1C.
What is the InChIKey of [2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine?
The InChIKey is QZFMQZCVUGZWJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-10-7-12(3)13(8-11(10)2)15-14(9-17)20-6-4-5-18-16(20)19-15/h4-8H,9,17H2,1-3H3.
What are the key properties of [2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine?
[2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine has a molecular weight of 266.35 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine is sourced from PubChem (CID 82304501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).