1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine

C12H20N2 — CID 59988898

IUPAC1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
SMILESCCC1c2cccn2CCN1C(C)C
InChIInChI=1S/C12H20N2/c1-4-11-12-6-5-7-13(12)8-9-14(11)10(2)3/h5-7,10-11H,4,8-9H2,1-3H3
InChIKeyMPADMKTUVNJGKI-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.66
Rot. Bonds2

About 1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine

1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine (PubChem CID 59988898) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
PubChem CID59988898
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
SMILESCCC1c2cccn2CCN1C(C)C
InChIInChI=1S/C12H20N2/c1-4-11-12-6-5-7-13(12)8-9-14(11)10(2)3/h5-7,10-11H,4,8-9H2,1-3H3
InChIKeyMPADMKTUVNJGKI-UHFFFAOYSA-N
XLogP2.66
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine?
The IUPAC name of 1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine (CID 59988898) is 1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine.
What is the SMILES notation for 1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine?
The canonical SMILES for 1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine is CCC1c2cccn2CCN1C(C)C.
What is the InChIKey of 1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine?
The InChIKey is MPADMKTUVNJGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-4-11-12-6-5-7-13(12)8-9-14(11)10(2)3/h5-7,10-11H,4,8-9H2,1-3H3.
What are the key properties of 1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine?
1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine has a molecular weight of 192.31 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 59988898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).