1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one

C10H11N3O2 — CID 175822352

IUPAC1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one
SMILESO=c1[nH]c2ncccc2n1C1CC(O)C1
InChIInChI=1S/C10H11N3O2/c14-7-4-6(5-7)13-8-2-1-3-11-9(8)12-10(13)15/h1-3,6-7,14H,4-5H2,(H,11,12,15)
InChIKeyGCHSKPMLHAKCOE-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.42
Rot. Bonds1

About 1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one

1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one (PubChem CID 175822352) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one
PubChem CID175822352
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one
SMILESO=c1[nH]c2ncccc2n1C1CC(O)C1
InChIInChI=1S/C10H11N3O2/c14-7-4-6(5-7)13-8-2-1-3-11-9(8)12-10(13)15/h1-3,6-7,14H,4-5H2,(H,11,12,15)
InChIKeyGCHSKPMLHAKCOE-UHFFFAOYSA-N
XLogP0.42
TPSA70.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one (CID 175822352) is 1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one is O=c1[nH]c2ncccc2n1C1CC(O)C1.
What is the InChIKey of 1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is GCHSKPMLHAKCOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c14-7-4-6(5-7)13-8-2-1-3-11-9(8)12-10(13)15/h1-3,6-7,14H,4-5H2,(H,11,12,15).
What are the key properties of 1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one?
1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 205.22 g/mol, XLogP of 0.42, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 175822352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).