(7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol

C20H20Cl2N2O — CID 134381464

IUPAC(7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol
SMILESOC(c1cc(Cl)cc2cncn12)C1CCC(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C20H20Cl2N2O/c21-16-7-5-14(6-8-16)13-1-3-15(4-2-13)20(25)19-10-17(22)9-18-11-23-12-24(18)19/h5-13,15,20,25H,1-4H2
InChIKeyXNVUTCLHKQSZHV-UHFFFAOYSA-N
MW375.30 g/mol
LogP5.65
Rot. Bonds3

About (7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol

(7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol (PubChem CID 134381464) has the molecular formula C20H20Cl2N2O and a molecular weight of 375.30 g/mol. Its IUPAC name is (7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol.

Molecular Properties

Compound Name(7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol
PubChem CID134381464
Molecular FormulaC20H20Cl2N2O
Molecular Weight375.30 g/mol
Exact Mass374.10
IUPAC Name(7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol
SMILESOC(c1cc(Cl)cc2cncn12)C1CCC(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C20H20Cl2N2O/c21-16-7-5-14(6-8-16)13-1-3-15(4-2-13)20(25)19-10-17(22)9-18-11-23-12-24(18)19/h5-13,15,20,25H,1-4H2
InChIKeyXNVUTCLHKQSZHV-UHFFFAOYSA-N
XLogP5.65
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.30
LogP ≤ 55.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol?
The IUPAC name of (7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol (CID 134381464) is (7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol.
What is the SMILES notation for (7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol?
The canonical SMILES for (7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol is OC(c1cc(Cl)cc2cncn12)C1CCC(c2ccc(Cl)cc2)CC1.
What is the InChIKey of (7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol?
The InChIKey is XNVUTCLHKQSZHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20Cl2N2O/c21-16-7-5-14(6-8-16)13-1-3-15(4-2-13)20(25)19-10-17(22)9-18-11-23-12-24(18)19/h5-13,15,20,25H,1-4H2.
What are the key properties of (7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol?
(7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol has a molecular weight of 375.30 g/mol, XLogP of 5.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-chloroimidazo[1,5-a]pyridin-5-yl)-[4-(4-chlorophenyl)cyclohexyl]methanol is sourced from PubChem (CID 134381464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).