1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine

C14H16N2 — CID 19095335

IUPAC1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
SMILESCC1NCCn2c(-c3ccccc3)ccc21
InChIInChI=1S/C14H16N2/c1-11-13-7-8-14(16(13)10-9-15-11)12-5-3-2-4-6-12/h2-8,11,15H,9-10H2,1H3
InChIKeyTVHNANHJGZNPQO-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.82
Rot. Bonds1

About 1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine

1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine (PubChem CID 19095335) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
PubChem CID19095335
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
SMILESCC1NCCn2c(-c3ccccc3)ccc21
InChIInChI=1S/C14H16N2/c1-11-13-7-8-14(16(13)10-9-15-11)12-5-3-2-4-6-12/h2-8,11,15H,9-10H2,1H3
InChIKeyTVHNANHJGZNPQO-UHFFFAOYSA-N
XLogP2.82
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine?
The IUPAC name of 1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine (CID 19095335) is 1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine.
What is the SMILES notation for 1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine?
The canonical SMILES for 1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine is CC1NCCn2c(-c3ccccc3)ccc21.
What is the InChIKey of 1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine?
The InChIKey is TVHNANHJGZNPQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-11-13-7-8-14(16(13)10-9-15-11)12-5-3-2-4-6-12/h2-8,11,15H,9-10H2,1H3.
What are the key properties of 1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine?
1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine has a molecular weight of 212.30 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 19095335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).