8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine

C18H18N4 — CID 11543843

IUPAC8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
SMILESNC1=NC(c2ccccc2)(c2ccccc2)C2=NCCCN12
InChIInChI=1S/C18H18N4/c19-17-21-18(14-8-3-1-4-9-14,15-10-5-2-6-11-15)16-20-12-7-13-22(16)17/h1-6,8-11H,7,12-13H2,(H2,19,21)
InChIKeyUFWSJOVQEPTPNE-UHFFFAOYSA-N
MW290.37 g/mol
LogP2.36
Rot. Bonds2

About 8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine

8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine (PubChem CID 11543843) has the molecular formula C18H18N4 and a molecular weight of 290.37 g/mol. Its IUPAC name is 8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine.

Molecular Properties

Compound Name8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
PubChem CID11543843
Molecular FormulaC18H18N4
Molecular Weight290.37 g/mol
Exact Mass290.15
IUPAC Name8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
SMILESNC1=NC(c2ccccc2)(c2ccccc2)C2=NCCCN12
InChIInChI=1S/C18H18N4/c19-17-21-18(14-8-3-1-4-9-14,15-10-5-2-6-11-15)16-20-12-7-13-22(16)17/h1-6,8-11H,7,12-13H2,(H2,19,21)
InChIKeyUFWSJOVQEPTPNE-UHFFFAOYSA-N
XLogP2.36
TPSA53.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine?
The IUPAC name of 8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine (CID 11543843) is 8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine.
What is the SMILES notation for 8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine?
The canonical SMILES for 8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine is NC1=NC(c2ccccc2)(c2ccccc2)C2=NCCCN12.
What is the InChIKey of 8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine?
The InChIKey is UFWSJOVQEPTPNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4/c19-17-21-18(14-8-3-1-4-9-14,15-10-5-2-6-11-15)16-20-12-7-13-22(16)17/h1-6,8-11H,7,12-13H2,(H2,19,21).
What are the key properties of 8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine?
8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine has a molecular weight of 290.37 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-diphenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine is sourced from PubChem (CID 11543843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).