[2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine

C21H20N4O — CID 11638762

IUPAC[2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine
SMILESCOc1ccccc1-c1cn2c(-c3ccccc3)c(CN)c(C)nc2n1
InChIInChI=1S/C21H20N4O/c1-14-17(12-22)20(15-8-4-3-5-9-15)25-13-18(24-21(25)23-14)16-10-6-7-11-19(16)26-2/h3-11,13H,12,22H2,1-2H3
InChIKeyAEGFXJNHKPNNAZ-UHFFFAOYSA-N
MW344.42 g/mol
LogP3.84
Rot. Bonds4

About [2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine

[2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine (PubChem CID 11638762) has the molecular formula C21H20N4O and a molecular weight of 344.42 g/mol. Its IUPAC name is [2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine.

Molecular Properties

Compound Name[2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine
PubChem CID11638762
Molecular FormulaC21H20N4O
Molecular Weight344.42 g/mol
Exact Mass344.16
IUPAC Name[2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine
SMILESCOc1ccccc1-c1cn2c(-c3ccccc3)c(CN)c(C)nc2n1
InChIInChI=1S/C21H20N4O/c1-14-17(12-22)20(15-8-4-3-5-9-15)25-13-18(24-21(25)23-14)16-10-6-7-11-19(16)26-2/h3-11,13H,12,22H2,1-2H3
InChIKeyAEGFXJNHKPNNAZ-UHFFFAOYSA-N
XLogP3.84
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine?
The IUPAC name of [2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine (CID 11638762) is [2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine.
What is the SMILES notation for [2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine?
The canonical SMILES for [2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine is COc1ccccc1-c1cn2c(-c3ccccc3)c(CN)c(C)nc2n1.
What is the InChIKey of [2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine?
The InChIKey is AEGFXJNHKPNNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O/c1-14-17(12-22)20(15-8-4-3-5-9-15)25-13-18(24-21(25)23-14)16-10-6-7-11-19(16)26-2/h3-11,13H,12,22H2,1-2H3.
What are the key properties of [2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine?
[2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine has a molecular weight of 344.42 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyphenyl)-7-methyl-5-phenylimidazo[1,2-a]pyrimidin-6-yl]methanamine is sourced from PubChem (CID 11638762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).