1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol

C14H18ClFN2O — CID 145166876

IUPAC1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol
SMILESCCCC(CC)C(O)c1c(F)c(Cl)cc2cncn12
InChIInChI=1S/C14H18ClFN2O/c1-3-5-9(4-2)14(19)13-12(16)11(15)6-10-7-17-8-18(10)13/h6-9,14,19H,3-5H2,1-2H3
InChIKeyURJYJWNFKAWYNO-UHFFFAOYSA-N
MW284.76 g/mol
LogP3.99
Rot. Bonds5

About 1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol

1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol (PubChem CID 145166876) has the molecular formula C14H18ClFN2O and a molecular weight of 284.76 g/mol. Its IUPAC name is 1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol.

Molecular Properties

Compound Name1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol
PubChem CID145166876
Molecular FormulaC14H18ClFN2O
Molecular Weight284.76 g/mol
Exact Mass284.11
IUPAC Name1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol
SMILESCCCC(CC)C(O)c1c(F)c(Cl)cc2cncn12
InChIInChI=1S/C14H18ClFN2O/c1-3-5-9(4-2)14(19)13-12(16)11(15)6-10-7-17-8-18(10)13/h6-9,14,19H,3-5H2,1-2H3
InChIKeyURJYJWNFKAWYNO-UHFFFAOYSA-N
XLogP3.99
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.76
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol?
The IUPAC name of 1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol (CID 145166876) is 1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol.
What is the SMILES notation for 1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol?
The canonical SMILES for 1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol is CCCC(CC)C(O)c1c(F)c(Cl)cc2cncn12.
What is the InChIKey of 1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol?
The InChIKey is URJYJWNFKAWYNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClFN2O/c1-3-5-9(4-2)14(19)13-12(16)11(15)6-10-7-17-8-18(10)13/h6-9,14,19H,3-5H2,1-2H3.
What are the key properties of 1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol?
1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol has a molecular weight of 284.76 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-chloro-6-fluoroimidazo[1,5-a]pyridin-5-yl)-2-ethylpentan-1-ol is sourced from PubChem (CID 145166876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).