cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol

C14H16Cl2N2O — CID 122609366

IUPACcyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol
SMILESOC(c1cc(Cl)c(Cl)c2cncn12)C1CCCCC1
InChIInChI=1S/C14H16Cl2N2O/c15-10-6-11(14(19)9-4-2-1-3-5-9)18-8-17-7-12(18)13(10)16/h6-9,14,19H,1-5H2
InChIKeyLKJPXULERNECRH-UHFFFAOYSA-N
MW299.20 g/mol
LogP4.25
Rot. Bonds2

About cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol

cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol (PubChem CID 122609366) has the molecular formula C14H16Cl2N2O and a molecular weight of 299.20 g/mol. Its IUPAC name is cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol.

Molecular Properties

Compound Namecyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol
PubChem CID122609366
Molecular FormulaC14H16Cl2N2O
Molecular Weight299.20 g/mol
Exact Mass298.06
IUPAC Namecyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol
SMILESOC(c1cc(Cl)c(Cl)c2cncn12)C1CCCCC1
InChIInChI=1S/C14H16Cl2N2O/c15-10-6-11(14(19)9-4-2-1-3-5-9)18-8-17-7-12(18)13(10)16/h6-9,14,19H,1-5H2
InChIKeyLKJPXULERNECRH-UHFFFAOYSA-N
XLogP4.25
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.20
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol?
The IUPAC name of cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol (CID 122609366) is cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol.
What is the SMILES notation for cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol?
The canonical SMILES for cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol is OC(c1cc(Cl)c(Cl)c2cncn12)C1CCCCC1.
What is the InChIKey of cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol?
The InChIKey is LKJPXULERNECRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Cl2N2O/c15-10-6-11(14(19)9-4-2-1-3-5-9)18-8-17-7-12(18)13(10)16/h6-9,14,19H,1-5H2.
What are the key properties of cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol?
cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol has a molecular weight of 299.20 g/mol, XLogP of 4.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(7,8-dichloroimidazo[1,5-a]pyridin-5-yl)methanol is sourced from PubChem (CID 122609366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).