1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol

C8H12N2O — CID 178053427

IUPAC1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol
SMILESCC(O)c1cn2c(n1)CCC2
InChIInChI=1S/C8H12N2O/c1-6(11)7-5-10-4-2-3-8(10)9-7/h5-6,11H,2-4H2,1H3
InChIKeyRTQHNNMJJJDMGD-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.88
Rot. Bonds1

About 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol

1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol (PubChem CID 178053427) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol
PubChem CID178053427
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol
SMILESCC(O)c1cn2c(n1)CCC2
InChIInChI=1S/C8H12N2O/c1-6(11)7-5-10-4-2-3-8(10)9-7/h5-6,11H,2-4H2,1H3
InChIKeyRTQHNNMJJJDMGD-UHFFFAOYSA-N
XLogP0.88
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol?
The IUPAC name of 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol (CID 178053427) is 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol.
What is the SMILES notation for 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol?
The canonical SMILES for 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol is CC(O)c1cn2c(n1)CCC2.
What is the InChIKey of 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol?
The InChIKey is RTQHNNMJJJDMGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-6(11)7-5-10-4-2-3-8(10)9-7/h5-6,11H,2-4H2,1H3.
What are the key properties of 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol?
1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol has a molecular weight of 152.20 g/mol, XLogP of 0.88, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)ethanol is sourced from PubChem (CID 178053427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).