(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol

C29H30N2O — CID 134381585

IUPAC(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol
SMILESOC(c1c(C2CC2)ccc2cncn12)C1CCC(c2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C29H30N2O/c32-29(28-27(24-12-13-24)17-16-26-18-30-19-31(26)28)25-14-10-23(11-15-25)22-8-6-21(7-9-22)20-4-2-1-3-5-20/h1-9,16-19,23-25,29,32H,10-15H2
InChIKeyGYRTWBCDERNXPO-UHFFFAOYSA-N
MW422.57 g/mol
LogP6.89
Rot. Bonds5

About (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol

(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol (PubChem CID 134381585) has the molecular formula C29H30N2O and a molecular weight of 422.57 g/mol. Its IUPAC name is (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol.

Molecular Properties

Compound Name(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol
PubChem CID134381585
Molecular FormulaC29H30N2O
Molecular Weight422.57 g/mol
Exact Mass422.24
IUPAC Name(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol
SMILESOC(c1c(C2CC2)ccc2cncn12)C1CCC(c2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C29H30N2O/c32-29(28-27(24-12-13-24)17-16-26-18-30-19-31(26)28)25-14-10-23(11-15-25)22-8-6-21(7-9-22)20-4-2-1-3-5-20/h1-9,16-19,23-25,29,32H,10-15H2
InChIKeyGYRTWBCDERNXPO-UHFFFAOYSA-N
XLogP6.89
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.57
LogP ≤ 56.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol?
The IUPAC name of (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol (CID 134381585) is (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol.
What is the SMILES notation for (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol?
The canonical SMILES for (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol is OC(c1c(C2CC2)ccc2cncn12)C1CCC(c2ccc(-c3ccccc3)cc2)CC1.
What is the InChIKey of (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol?
The InChIKey is GYRTWBCDERNXPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30N2O/c32-29(28-27(24-12-13-24)17-16-26-18-30-19-31(26)28)25-14-10-23(11-15-25)22-8-6-21(7-9-22)20-4-2-1-3-5-20/h1-9,16-19,23-25,29,32H,10-15H2.
What are the key properties of (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol?
(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol has a molecular weight of 422.57 g/mol, XLogP of 6.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-phenylphenyl)cyclohexyl]methanol is sourced from PubChem (CID 134381585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).