7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine

C15H19N3 — CID 136839872

IUPAC7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
SMILESCCCc1ccc(C2CCn3ccnc3N2)cc1
InChIInChI=1S/C15H19N3/c1-2-3-12-4-6-13(7-5-12)14-8-10-18-11-9-16-15(18)17-14/h4-7,9,11,14H,2-3,8,10H2,1H3,(H,16,17)
InChIKeyVMEFBMPNMKIQSU-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.39
Rot. Bonds3

About 7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine

7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine (PubChem CID 136839872) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
PubChem CID136839872
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
SMILESCCCc1ccc(C2CCn3ccnc3N2)cc1
InChIInChI=1S/C15H19N3/c1-2-3-12-4-6-13(7-5-12)14-8-10-18-11-9-16-15(18)17-14/h4-7,9,11,14H,2-3,8,10H2,1H3,(H,16,17)
InChIKeyVMEFBMPNMKIQSU-UHFFFAOYSA-N
XLogP3.39
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?
The IUPAC name of 7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine (CID 136839872) is 7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?
The canonical SMILES for 7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine is CCCc1ccc(C2CCn3ccnc3N2)cc1.
What is the InChIKey of 7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?
The InChIKey is VMEFBMPNMKIQSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-2-3-12-4-6-13(7-5-12)14-8-10-18-11-9-16-15(18)17-14/h4-7,9,11,14H,2-3,8,10H2,1H3,(H,16,17).
What are the key properties of 7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?
7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine has a molecular weight of 241.34 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-propylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 136839872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).