1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol

C23H30N2O — CID 134343945

IUPAC1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol
SMILESOC(CC12CCC3CCC(CC3C1)C2)c1c(C2CC2)ccn2cncc12
InChIInChI=1S/C23H30N2O/c26-21(12-23-7-5-16-2-1-15(10-23)9-18(16)11-23)22-19(17-3-4-17)6-8-25-14-24-13-20(22)25/h6,8,13-18,21,26H,1-5,7,9-12H2
InChIKeyFTCGISPEHFKZBO-UHFFFAOYSA-N
MW350.51 g/mol
LogP5.24
Rot. Bonds4

About 1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol

1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol (PubChem CID 134343945) has the molecular formula C23H30N2O and a molecular weight of 350.51 g/mol. Its IUPAC name is 1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol.

Molecular Properties

Compound Name1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol
PubChem CID134343945
Molecular FormulaC23H30N2O
Molecular Weight350.51 g/mol
Exact Mass350.24
IUPAC Name1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol
SMILESOC(CC12CCC3CCC(CC3C1)C2)c1c(C2CC2)ccn2cncc12
InChIInChI=1S/C23H30N2O/c26-21(12-23-7-5-16-2-1-15(10-23)9-18(16)11-23)22-19(17-3-4-17)6-8-25-14-24-13-20(22)25/h6,8,13-18,21,26H,1-5,7,9-12H2
InChIKeyFTCGISPEHFKZBO-UHFFFAOYSA-N
XLogP5.24
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.51
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol?
The IUPAC name of 1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol (CID 134343945) is 1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol.
What is the SMILES notation for 1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol?
The canonical SMILES for 1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol is OC(CC12CCC3CCC(CC3C1)C2)c1c(C2CC2)ccn2cncc12.
What is the InChIKey of 1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol?
The InChIKey is FTCGISPEHFKZBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O/c26-21(12-23-7-5-16-2-1-15(10-23)9-18(16)11-23)22-19(17-3-4-17)6-8-25-14-24-13-20(22)25/h6,8,13-18,21,26H,1-5,7,9-12H2.
What are the key properties of 1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol?
1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol has a molecular weight of 350.51 g/mol, XLogP of 5.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-2-(1-tricyclo[5.3.1.04,9]undecanyl)ethanol is sourced from PubChem (CID 134343945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).