[4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol

C20H22ClN3O2 — CID 140914407

IUPAC[4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol
SMILESCOc1cc(CO)c(-c2cn3ccc(C4CCNCC4)cc3n2)cc1Cl
InChIInChI=1S/C20H22ClN3O2/c1-26-19-8-15(12-25)16(10-17(19)21)18-11-24-7-4-14(9-20(24)23-18)13-2-5-22-6-3-13/h4,7-11,13,22,25H,2-3,5-6,12H2,1H3
InChIKeyWETZURXQFKQLIV-UHFFFAOYSA-N
MW371.87 g/mol
LogP3.62
Rot. Bonds4

About [4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol

[4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol (PubChem CID 140914407) has the molecular formula C20H22ClN3O2 and a molecular weight of 371.87 g/mol. Its IUPAC name is [4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol.

Molecular Properties

Compound Name[4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol
PubChem CID140914407
Molecular FormulaC20H22ClN3O2
Molecular Weight371.87 g/mol
Exact Mass371.14
IUPAC Name[4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol
SMILESCOc1cc(CO)c(-c2cn3ccc(C4CCNCC4)cc3n2)cc1Cl
InChIInChI=1S/C20H22ClN3O2/c1-26-19-8-15(12-25)16(10-17(19)21)18-11-24-7-4-14(9-20(24)23-18)13-2-5-22-6-3-13/h4,7-11,13,22,25H,2-3,5-6,12H2,1H3
InChIKeyWETZURXQFKQLIV-UHFFFAOYSA-N
XLogP3.62
TPSA58.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.87
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol?
The IUPAC name of [4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol (CID 140914407) is [4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol.
What is the SMILES notation for [4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol?
The canonical SMILES for [4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol is COc1cc(CO)c(-c2cn3ccc(C4CCNCC4)cc3n2)cc1Cl.
What is the InChIKey of [4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol?
The InChIKey is WETZURXQFKQLIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN3O2/c1-26-19-8-15(12-25)16(10-17(19)21)18-11-24-7-4-14(9-20(24)23-18)13-2-5-22-6-3-13/h4,7-11,13,22,25H,2-3,5-6,12H2,1H3.
What are the key properties of [4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol?
[4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol has a molecular weight of 371.87 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-5-methoxy-2-(7-piperidin-4-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol is sourced from PubChem (CID 140914407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).