2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine

C18H16N4O — CID 4580669

IUPAC2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
SMILESCc1ccc(-c2nc3ncccn3c2Nc2ccccc2C)o1
InChIInChI=1S/C18H16N4O/c1-12-6-3-4-7-14(12)20-17-16(15-9-8-13(2)23-15)21-18-19-10-5-11-22(17)18/h3-11,20H,1-2H3
InChIKeyQXGMJAAKQKAZEU-UHFFFAOYSA-N
MW304.35 g/mol
LogP4.35
Rot. Bonds3

About 2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine

2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine (PubChem CID 4580669) has the molecular formula C18H16N4O and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine.

Molecular Properties

Compound Name2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
PubChem CID4580669
Molecular FormulaC18H16N4O
Molecular Weight304.35 g/mol
Exact Mass304.13
IUPAC Name2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
SMILESCc1ccc(-c2nc3ncccn3c2Nc2ccccc2C)o1
InChIInChI=1S/C18H16N4O/c1-12-6-3-4-7-14(12)20-17-16(15-9-8-13(2)23-15)21-18-19-10-5-11-22(17)18/h3-11,20H,1-2H3
InChIKeyQXGMJAAKQKAZEU-UHFFFAOYSA-N
XLogP4.35
TPSA55.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine?
The IUPAC name of 2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine (CID 4580669) is 2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine.
What is the SMILES notation for 2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine?
The canonical SMILES for 2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine is Cc1ccc(-c2nc3ncccn3c2Nc2ccccc2C)o1.
What is the InChIKey of 2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine?
The InChIKey is QXGMJAAKQKAZEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O/c1-12-6-3-4-7-14(12)20-17-16(15-9-8-13(2)23-15)21-18-19-10-5-11-22(17)18/h3-11,20H,1-2H3.
What are the key properties of 2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine?
2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine has a molecular weight of 304.35 g/mol, XLogP of 4.35, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylfuran-2-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine is sourced from PubChem (CID 4580669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).