2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine

C11H20N2 — CID 131991652

IUPAC2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine
SMILESCC(C)C1=C2CCCN2CCN1C
InChIInChI=1S/C11H20N2/c1-9(2)11-10-5-4-6-13(10)8-7-12(11)3/h9H,4-8H2,1-3H3
InChIKeyVRLDQCDKEYUMCO-UHFFFAOYSA-N
MW180.30 g/mol
LogP1.90
Rot. Bonds1

About 2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine

2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine (PubChem CID 131991652) has the molecular formula C11H20N2 and a molecular weight of 180.30 g/mol. Its IUPAC name is 2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine
PubChem CID131991652
Molecular FormulaC11H20N2
Molecular Weight180.30 g/mol
Exact Mass180.16
IUPAC Name2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine
SMILESCC(C)C1=C2CCCN2CCN1C
InChIInChI=1S/C11H20N2/c1-9(2)11-10-5-4-6-13(10)8-7-12(11)3/h9H,4-8H2,1-3H3
InChIKeyVRLDQCDKEYUMCO-UHFFFAOYSA-N
XLogP1.90
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.30
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine?
The IUPAC name of 2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine (CID 131991652) is 2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine.
What is the SMILES notation for 2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine?
The canonical SMILES for 2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine is CC(C)C1=C2CCCN2CCN1C.
What is the InChIKey of 2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine?
The InChIKey is VRLDQCDKEYUMCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-9(2)11-10-5-4-6-13(10)8-7-12(11)3/h9H,4-8H2,1-3H3.
What are the key properties of 2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine?
2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine has a molecular weight of 180.30 g/mol, XLogP of 1.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 131991652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).