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

C23H25BrN2O — CID 134381260

IUPAC[4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol
SMILESOC(c1c(C2CC2)ccc2cncn12)C1CCC(c2ccc(Br)cc2)CC1
InChIInChI=1S/C23H25BrN2O/c24-19-9-7-16(8-10-19)15-1-5-18(6-2-15)23(27)22-21(17-3-4-17)12-11-20-13-25-14-26(20)22/h7-15,17-18,23,27H,1-6H2
InChIKeyMVQNHZKTZJOLJQ-UHFFFAOYSA-N
MW425.37 g/mol
LogP5.98
Rot. Bonds4

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

[4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol (PubChem CID 134381260) has the molecular formula C23H25BrN2O and a molecular weight of 425.37 g/mol. Its IUPAC name is [4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol.

Molecular Properties

Compound Name[4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol
PubChem CID134381260
Molecular FormulaC23H25BrN2O
Molecular Weight425.37 g/mol
Exact Mass424.12
IUPAC Name[4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol
SMILESOC(c1c(C2CC2)ccc2cncn12)C1CCC(c2ccc(Br)cc2)CC1
InChIInChI=1S/C23H25BrN2O/c24-19-9-7-16(8-10-19)15-1-5-18(6-2-15)23(27)22-21(17-3-4-17)12-11-20-13-25-14-26(20)22/h7-15,17-18,23,27H,1-6H2
InChIKeyMVQNHZKTZJOLJQ-UHFFFAOYSA-N
XLogP5.98
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.37
LogP ≤ 55.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol?
The IUPAC name of [4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol (CID 134381260) is [4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol.
What is the SMILES notation for [4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol?
The canonical SMILES for [4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol is OC(c1c(C2CC2)ccc2cncn12)C1CCC(c2ccc(Br)cc2)CC1.
What is the InChIKey of [4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol?
The InChIKey is MVQNHZKTZJOLJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25BrN2O/c24-19-9-7-16(8-10-19)15-1-5-18(6-2-15)23(27)22-21(17-3-4-17)12-11-20-13-25-14-26(20)22/h7-15,17-18,23,27H,1-6H2.
What are the key properties of [4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol?
[4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol has a molecular weight of 425.37 g/mol, XLogP of 5.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-bromophenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol is sourced from PubChem (CID 134381260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).