1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine

C18H15N3 — CID 11184894

IUPAC1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine
SMILESc1ccc(C2=NCCn3c2ccc3-c2cccnc2)cc1
InChIInChI=1S/C18H15N3/c1-2-5-14(6-3-1)18-17-9-8-16(21(17)12-11-20-18)15-7-4-10-19-13-15/h1-10,13H,11-12H2
InChIKeyHKICJPPKZLNUQD-UHFFFAOYSA-N
MW273.34 g/mol
LogP3.40
Rot. Bonds2

About 1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine

1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine (PubChem CID 11184894) has the molecular formula C18H15N3 and a molecular weight of 273.34 g/mol. Its IUPAC name is 1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine
PubChem CID11184894
Molecular FormulaC18H15N3
Molecular Weight273.34 g/mol
Exact Mass273.13
IUPAC Name1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine
SMILESc1ccc(C2=NCCn3c2ccc3-c2cccnc2)cc1
InChIInChI=1S/C18H15N3/c1-2-5-14(6-3-1)18-17-9-8-16(21(17)12-11-20-18)15-7-4-10-19-13-15/h1-10,13H,11-12H2
InChIKeyHKICJPPKZLNUQD-UHFFFAOYSA-N
XLogP3.40
TPSA30.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine?
The IUPAC name of 1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine (CID 11184894) is 1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine.
What is the SMILES notation for 1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine?
The canonical SMILES for 1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine is c1ccc(C2=NCCn3c2ccc3-c2cccnc2)cc1.
What is the InChIKey of 1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine?
The InChIKey is HKICJPPKZLNUQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3/c1-2-5-14(6-3-1)18-17-9-8-16(21(17)12-11-20-18)15-7-4-10-19-13-15/h1-10,13H,11-12H2.
What are the key properties of 1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine?
1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine has a molecular weight of 273.34 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-6-pyridin-3-yl-3,4-dihydropyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 11184894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).