2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol

C14H19N3O — CID 117136102

IUPAC2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol
SMILESCCN1CCC(Cc2cn3cccc(O)c3n2)C1
InChIInChI=1S/C14H19N3O/c1-2-16-7-5-11(9-16)8-12-10-17-6-3-4-13(18)14(17)15-12/h3-4,6,10-11,18H,2,5,7-9H2,1H3
InChIKeyQYOLHCPWTHTQJU-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.92
Rot. Bonds3

About 2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol

2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol (PubChem CID 117136102) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol.

Molecular Properties

Compound Name2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol
PubChem CID117136102
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol
SMILESCCN1CCC(Cc2cn3cccc(O)c3n2)C1
InChIInChI=1S/C14H19N3O/c1-2-16-7-5-11(9-16)8-12-10-17-6-3-4-13(18)14(17)15-12/h3-4,6,10-11,18H,2,5,7-9H2,1H3
InChIKeyQYOLHCPWTHTQJU-UHFFFAOYSA-N
XLogP1.92
TPSA40.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol?
The IUPAC name of 2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol (CID 117136102) is 2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol.
What is the SMILES notation for 2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol?
The canonical SMILES for 2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol is CCN1CCC(Cc2cn3cccc(O)c3n2)C1.
What is the InChIKey of 2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol?
The InChIKey is QYOLHCPWTHTQJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-2-16-7-5-11(9-16)8-12-10-17-6-3-4-13(18)14(17)15-12/h3-4,6,10-11,18H,2,5,7-9H2,1H3.
What are the key properties of 2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol?
2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol has a molecular weight of 245.33 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol is sourced from PubChem (CID 117136102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).