imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone

C17H16N4O — CID 154878050

IUPACimidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone
SMILESO=C(c1ccn2ccnc2n1)N1CCC(c2ccccc2)C1
InChIInChI=1S/C17H16N4O/c22-16(15-7-10-20-11-8-18-17(20)19-15)21-9-6-14(12-21)13-4-2-1-3-5-13/h1-5,7-8,10-11,14H,6,9,12H2
InChIKeyAIAPOHJXIJNWLM-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.36
Rot. Bonds2

About imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone

imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone (PubChem CID 154878050) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Nameimidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone
PubChem CID154878050
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC Nameimidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone
SMILESO=C(c1ccn2ccnc2n1)N1CCC(c2ccccc2)C1
InChIInChI=1S/C17H16N4O/c22-16(15-7-10-20-11-8-18-17(20)19-15)21-9-6-14(12-21)13-4-2-1-3-5-13/h1-5,7-8,10-11,14H,6,9,12H2
InChIKeyAIAPOHJXIJNWLM-UHFFFAOYSA-N
XLogP2.36
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone?
The IUPAC name of imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone (CID 154878050) is imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone.
What is the SMILES notation for imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone?
The canonical SMILES for imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone is O=C(c1ccn2ccnc2n1)N1CCC(c2ccccc2)C1.
What is the InChIKey of imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone?
The InChIKey is AIAPOHJXIJNWLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c22-16(15-7-10-20-11-8-18-17(20)19-15)21-9-6-14(12-21)13-4-2-1-3-5-13/h1-5,7-8,10-11,14H,6,9,12H2.
What are the key properties of imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone?
imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone has a molecular weight of 292.34 g/mol, XLogP of 2.36, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyrimidin-7-yl-(3-phenylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 154878050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).