1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol

C8H13N3O — CID 83438766

IUPAC1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol
SMILESCC(O)c1nc2c([nH]1)CCCN2
InChIInChI=1S/C8H13N3O/c1-5(12)7-10-6-3-2-4-9-8(6)11-7/h5,9,12H,2-4H2,1H3,(H,10,11)
InChIKeyCAUVYTUXSAEWCP-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.82
Rot. Bonds1

About 1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol

1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol (PubChem CID 83438766) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol.

Molecular Properties

Compound Name1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol
PubChem CID83438766
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol
SMILESCC(O)c1nc2c([nH]1)CCCN2
InChIInChI=1S/C8H13N3O/c1-5(12)7-10-6-3-2-4-9-8(6)11-7/h5,9,12H,2-4H2,1H3,(H,10,11)
InChIKeyCAUVYTUXSAEWCP-UHFFFAOYSA-N
XLogP0.82
TPSA60.94 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol?
The IUPAC name of 1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol (CID 83438766) is 1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol.
What is the SMILES notation for 1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol?
The canonical SMILES for 1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol is CC(O)c1nc2c([nH]1)CCCN2.
What is the InChIKey of 1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol?
The InChIKey is CAUVYTUXSAEWCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-5(12)7-10-6-3-2-4-9-8(6)11-7/h5,9,12H,2-4H2,1H3,(H,10,11).
What are the key properties of 1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol?
1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol has a molecular weight of 167.21 g/mol, XLogP of 0.82, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5,6,7-tetrahydro-1H-imidazo[4,5-b]pyridin-2-yl)ethanol is sourced from PubChem (CID 83438766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).