2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride

C7H11ClN2O — CID 67975695

IUPAC2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride
SMILESCl.O=C1CC=C2CNCCN12
InChIInChI=1S/C7H10N2O.ClH/c10-7-2-1-6-5-8-3-4-9(6)7;/h1,8H,2-5H2;1H
InChIKeyOSIZEHCICAICLL-UHFFFAOYSA-N
MW174.63 g/mol
LogP0.13
Rot. Bonds

About 2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride

2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride (PubChem CID 67975695) has the molecular formula C7H11ClN2O and a molecular weight of 174.63 g/mol. Its IUPAC name is 2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride.

Molecular Properties

Compound Name2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride
PubChem CID67975695
Molecular FormulaC7H11ClN2O
Molecular Weight174.63 g/mol
Exact Mass174.06
IUPAC Name2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride
SMILESCl.O=C1CC=C2CNCCN12
InChIInChI=1S/C7H10N2O.ClH/c10-7-2-1-6-5-8-3-4-9(6)7;/h1,8H,2-5H2;1H
InChIKeyOSIZEHCICAICLL-UHFFFAOYSA-N
XLogP0.13
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.63
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride?
The IUPAC name of 2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride (CID 67975695) is 2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride.
What is the SMILES notation for 2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride?
The canonical SMILES for 2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride is Cl.O=C1CC=C2CNCCN12.
What is the InChIKey of 2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride?
The InChIKey is OSIZEHCICAICLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O.ClH/c10-7-2-1-6-5-8-3-4-9(6)7;/h1,8H,2-5H2;1H.
What are the key properties of 2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride?
2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride has a molecular weight of 174.63 g/mol, XLogP of 0.13, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,7-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride is sourced from PubChem (CID 67975695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).