1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol

C24H23ClN2O — CID 67046246

IUPAC1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol
SMILESCCCCC(O)c1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)cn3c2)c1
InChIInChI=1S/C24H23ClN2O/c1-2-3-7-23(28)19-6-4-5-18(14-19)20-10-13-24-26-22(16-27(24)15-20)17-8-11-21(25)12-9-17/h4-6,8-16,23,28H,2-3,7H2,1H3
InChIKeyLGZVZMDOBADMFD-UHFFFAOYSA-N
MW390.91 g/mol
LogP6.55
Rot. Bonds6

About 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol

1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol (PubChem CID 67046246) has the molecular formula C24H23ClN2O and a molecular weight of 390.91 g/mol. Its IUPAC name is 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol.

Molecular Properties

Compound Name1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol
PubChem CID67046246
Molecular FormulaC24H23ClN2O
Molecular Weight390.91 g/mol
Exact Mass390.15
IUPAC Name1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol
SMILESCCCCC(O)c1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)cn3c2)c1
InChIInChI=1S/C24H23ClN2O/c1-2-3-7-23(28)19-6-4-5-18(14-19)20-10-13-24-26-22(16-27(24)15-20)17-8-11-21(25)12-9-17/h4-6,8-16,23,28H,2-3,7H2,1H3
InChIKeyLGZVZMDOBADMFD-UHFFFAOYSA-N
XLogP6.55
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.91
LogP ≤ 56.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol?
The IUPAC name of 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol (CID 67046246) is 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol.
What is the SMILES notation for 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol?
The canonical SMILES for 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol is CCCCC(O)c1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)cn3c2)c1.
What is the InChIKey of 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol?
The InChIKey is LGZVZMDOBADMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClN2O/c1-2-3-7-23(28)19-6-4-5-18(14-19)20-10-13-24-26-22(16-27(24)15-20)17-8-11-21(25)12-9-17/h4-6,8-16,23,28H,2-3,7H2,1H3.
What are the key properties of 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol?
1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol has a molecular weight of 390.91 g/mol, XLogP of 6.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]pentan-1-ol is sourced from PubChem (CID 67046246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).